3-nitro-4-[2-oxidanylidene-2-[(4-thiophen-2-yl-1,3-thiazol-2-yl)amino]ethyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[2-oxidanylidene-2-[(4-thiophen-2-yl-1,3-thiazol-2-yl)amino]ethyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-[[4-(2-thienyl)thiazol-2-yl]amino]ethyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-oxo-2-[(4-thiophen-2-yl-2-thiazolyl)amino]ethyl]thio]benzamide IUPAC Name: 3-nitro-4-[2-oxo-2-[(4-thiophen-2-yl-1,3-thiazol-2-yl)amino]ethyl]sulfanylbenzamide Traditional Name: 4-[[2-keto-2-[[4-(2-thienyl)thiazol-2-yl]amino]ethyl]thio]-3-nitro-benzamide Formula: C16H12N4O4S3 MolecularWeight: 420.48588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CSC(=N2)NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C2=CSC(=N2)NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4S3/c17-15(22)9-3-4-13(11(6-9)20(23)24)26-8-14(21)19-16-18-10(7-27-16)12-2-1-5-25-12/h1-7H,8H2,(H2,17,22)(H,18,19,21)