N-cyclopropyl-4-(4-methylphenyl)sulfanyl-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-4-(4-methylphenyl)sulfanyl-3-nitro-benzamide Openeye Name: N-cyclopropyl-3-nitro-4-(p-tolylsulfanyl)benzamide CAS Name: N-cyclopropyl-4-[(4-methylphenyl)thio]-3-nitrobenzamide IUPAC Name: N-cyclopropyl-4-(4-methylphenyl)sulfanyl-3-nitrobenzamide Traditional Name: N-cyclopropyl-3-nitro-4-(p-tolylthio)benzamide Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O3S/c1-11-2-7-14(8-3-11)23-16-9-4-12(10-15(16)19(21)22)17(20)18-13-5-6-13/h2-4,7-10,13H,5-6H2,1H3,(H,18,20)