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

Systemtic Name: 4-methoxy-N-[[5-(2-phenoxyethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-methoxy-N-[[5-(2-phenoxyethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-methoxy-N-[[5-(2-phenoxyethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-methoxy-N-[[5-(2-phenoxyethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 4-methoxy-N-[[5-(2-phenoxyethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCCOC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCCOC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O3S/c1-31-21-14-12-19(13-15-21)24(30)26-18-23-27-28-25(29(23)20-8-4-2-5-9-20)33-17-16-32-22-10-6-3-7-11-22/h2-15H,16-18H2,1H3,(H,26,30)