4-(methylamino)-N-[2-(4-methylphenyl)sulfanylethyl]-3-nitro-benzamide

Systemtic Name: 4-(methylamino)-N-[2-(4-methylphenyl)sulfanylethyl]-3-nitro-benzamide Openeye Name: 4-(methylamino)-3-nitro-N-[2-(p-tolylsulfanyl)ethyl]benzamide CAS Name: 4-(methylamino)-N-[2-[(4-methylphenyl)thio]ethyl]-3-nitrobenzamide IUPAC Name: 4-(methylamino)-N-[2-(4-methylphenyl)sulfanylethyl]-3-nitrobenzamide Traditional Name: 4-(methylamino)-3-nitro-N-[2-(p-tolylthio)ethyl]benzamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3S/c1-12-3-6-14(7-4-12)24-10-9-19-17(21)13-5-8-15(18-2)16(11-13)20(22)23/h3-8,11,18H,9-10H2,1-2H3,(H,19,21)