N-(2-methoxy-5-nitro-phenyl)-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(2-methoxy-5-nitrophenyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-3-(p-tolylthio)propionamide Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H18N2O4S/c1-12-3-6-14(7-4-12)24-10-9-17(20)18-15-11-13(19(21)22)5-8-16(15)23-2/h3-8,11H,9-10H2,1-2H3,(H,18,20)