3-methoxy-N-[[4-(3-methylphenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 3-methoxy-N-[[4-(3-methylphenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 3-methoxy-N-[[4-(m-tolyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 3-methoxy-N-[[4-(3-methylphenyl)-5-(phenacylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 3-methoxy-N-[[4-(3-methylphenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 3-methoxy-N-[[4-(m-tolyl)-5-(phenacylthio)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)C3=CC=CC=C3)CNC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)C3=CC=CC=C3)CNC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H24N4O3S/c1-18-8-6-12-21(14-18)30-24(16-27-25(32)20-11-7-13-22(15-20)33-2)28-29-26(30)34-17-23(31)19-9-4-3-5-10-19/h3-15H,16-17H2,1-2H3,(H,27,32)