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

Systemtic Name: 4-methoxy-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide Openeye Name: 4-methoxy-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide CAS Name: 4-methoxy-N-[[4-methyl-5-(phenacylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-methoxy-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide Traditional Name: 4-methoxy-N-[[4-methyl-5-(phenacylthio)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H20N4O3S/c1-24-18(12-21-19(26)15-8-10-16(27-2)11-9-15)22-23-20(24)28-13-17(25)14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3,(H,21,26)