N-(4-acetamidophenyl)-2-(2-chloranyl-4-nitro-phenyl)sulfanyl-benzamide

Systemtic Name: N-(4-acetamidophenyl)-2-(2-chloranyl-4-nitro-phenyl)sulfanyl-benzamide Openeye Name: N-(4-acetamidophenyl)-2-(2-chloro-4-nitro-phenyl)sulfanyl-benzamide CAS Name: N-(4-acetamidophenyl)-2-[(2-chloro-4-nitrophenyl)thio]benzamide IUPAC Name: N-(4-acetamidophenyl)-2-(2-chloro-4-nitrophenyl)sulfanylbenzamide Traditional Name: N-(4-acetamidophenyl)-2-[(2-chloro-4-nitro-phenyl)thio]benzamide Formula: C21H16ClN3O4S MolecularWeight: 441.88744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H16ClN3O4S/c1-13(26)23-14-6-8-15(9-7-14)24-21(27)17-4-2-3-5-19(17)30-20-11-10-16(25(28)29)12-18(20)22/h2-12H,1H3,(H,23,26)(H,24,27)