N-(4-acetamidophenyl)-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-(4-acetamidophenyl)-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-(4-acetamidophenyl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-(4-acetamidophenyl)-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-(4-acetamidophenyl)-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-(4-acetamidophenyl)-4-(methylthio)-3-nitro-benzamide Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O4S/c1-10(20)17-12-4-6-13(7-5-12)18-16(21)11-3-8-15(24-2)14(9-11)19(22)23/h3-9H,1-2H3,(H,17,20)(H,18,21)