2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-nitrophenyl)carbamoyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-nitrophenyl)carbamoyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-nitrophenyl)carbamoyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(4-nitroanilino)-oxomethyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-nitrophenyl)carbamoyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(4-nitrophenyl)carbamoyl]acetamide Formula: C16H12N4O4S2 MolecularWeight: 388.42088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4S2/c21-14(9-25-16-18-12-3-1-2-4-13(12)26-16)19-15(22)17-10-5-7-11(8-6-10)20(23)24/h1-8H,9H2,(H2,17,19,21,22)