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2-(1,3-benzothiazol-2-yl)-3-hydroxy-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile
2-(1,3-benzothiazol-2-yl)-3-hydroxy-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile
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![2-(1,3-benzothiazol-2-yl)-3-hydroxy-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/dcea0e48497745329215c04ad5dff8b1.png "2-(1,3-benzothiazol-2-yl)-3-hydroxy-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile")
2-(1,3-benzothiazol-2-yl)-3-hydroxy-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile
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CAS No:
451511-06-1
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Formula:
C14H11N5OS2
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Chemical Name:
2-(1,3-benzothiazol-2-yl)-3-hydroxy-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile
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Synonyms:
Z19814262;2-(2,3-dihydro-1,3-benzothiazol-2-ylidene)-4-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-oxobutanenitrile;451511-06-1
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CAS No:
2-(1,3-benzothiazol-2-yl)-3-hydroxy-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile Basic Attributes
329.4 g/mol
329.04050234 g/mol
Computed Properties
Molecular Weight:329.4
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:329.04050234
Monoisotopic Mass:329.04050234
Topological Polar Surface Area:141
Heavy Atom Count:22
Complexity:491
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-(1,3-benzothiazol-2-yl)-3-hydroxy-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile
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