3-(3,4-dimethoxyphenyl)-4-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]-1H-1,2,4-triazole-5-thione
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![3-(3,4-dimethoxyphenyl)-4-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]-1H-1,2,4-triazole-5-thione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8a3766b033d74f2a9899617368aa8a94.png "3-(3,4-dimethoxyphenyl)-4-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]-1H-1,2,4-triazole-5-thione")
3-(3,4-dimethoxyphenyl)-4-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]-1H-1,2,4-triazole-5-thione
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CAS No:
488839-93-6
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Formula:
C19H17N5O4S
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Chemical Name:
3-(3,4-dimethoxyphenyl)-4-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]-1H-1,2,4-triazole-5-thione
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Synonyms:
STK566804;STK996871;AKOS002176402;AKOS005492493;ST50061928;4-[(1E,3E)-4-(2-nitrophenyl)-1-azabuta-1,3-dienyl]-5-(3,4-dimethoxyphenyl)-1,2 ,4-triazole-3-thiol;488839-93-6;5-(3,4-dimethoxyphenyl)-4-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione;5-(3,4-dimethoxyphenyl)-4-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}-4H-1,2,4-triazole-3-thiol;5-(3,4-dimethoxyphenyl)-4-{[(E,2E)-3-(2-nitrophenyl)-2-propenylidene]amino}-4H-1,2,4-triazol-3-yl hydrosulfide
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CAS No:
3-(3,4-dimethoxyphenyl)-4-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]-1H-1,2,4-triazole-5-thione Basic Attributes
411.4 g/mol
411.10012521 g/mol
Computed Properties
Molecular Weight:411.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:411.10012521
Monoisotopic Mass:411.10012521
Topological Polar Surface Area:136
Heavy Atom Count:29
Complexity:693
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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