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

Systemtic Name: 4-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-3-nitro-benzamide Openeye Name: 4-methyl-3-nitro-N-[2-(p-tolylsulfanyl)ethyl]benzamide CAS Name: 4-methyl-N-[2-[(4-methylphenyl)thio]ethyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-3-nitrobenzamide Traditional Name: 4-methyl-3-nitro-N-[2-(p-tolylthio)ethyl]benzamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3S/c1-12-3-7-15(8-4-12)23-10-9-18-17(20)14-6-5-13(2)16(11-14)19(21)22/h3-8,11H,9-10H2,1-2H3,(H,18,20)