4-([(E)-(3-NITROPHENYL)METHYLIDENE]AMINO)-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE
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4-([(E)-(3-NITROPHENYL)METHYLIDENE]AMINO)-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE
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CAS No:
118159-01-6
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Formula:
C13H9N5O2S2
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Chemical Name:
4-([(E)-(3-NITROPHENYL)METHYLIDENE]AMINO)-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE
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Synonyms:
4-{[(E)-(3-nitrophenyl)methylidene]amino}-5-(2-thienyl)-4H-1,2,4-triazole-3-thiol;KS-00001S6S;AKOS030241323;MCULE-7487306746
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CAS No:
4-([(E)-(3-NITROPHENYL)METHYLIDENE]AMINO)-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE Basic Attributes
331.37
331.02
Computed Properties
Molecular Weight:331.4
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:331.01976689
Monoisotopic Mass:331.01976689
Topological Polar Surface Area:146
Heavy Atom Count:22
Complexity:519
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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