N-(4-methoxy-2-nitro-phenyl)-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-3-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-methoxy-2-nitrophenyl)-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-3-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCCC(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCCC(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4S/c1-13-5-3-4-6-16(13)23-12-20-22-19(23)29-10-9-18(25)21-15-8-7-14(28-2)11-17(15)24(26)27/h3-8,11-12H,9-10H2,1-2H3,(H,21,25)