N-(3-cyanothiophen-2-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(3-cyano-2-thienyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N-(3-cyano-2-thiophenyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N-(3-cyanothiophen-2-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(3-cyano-2-thienyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide Formula: C14H8N4O3S3 MolecularWeight: 376.43332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)SCC(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)SCC(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C14H8N4O3S3/c15-6-8-3-4-22-13(8)17-12(19)7-23-14-16-10-2-1-9(18(20)21)5-11(10)24-14/h1-5H,7H2,(H,17,19)