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

Systemtic Name: 4-methoxy-N-[(5-methylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)methyl]benzamide Openeye Name: 4-methoxy-N-[(5-methylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)methyl]benzamide CAS Name: 4-methoxy-N-[[5-(methylthio)-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-methoxy-N-[(5-methylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)methyl]benzamide Traditional Name: 4-methoxy-N-[[5-(methylthio)-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide Formula: C20H22N4O2S MolecularWeight: 382.47928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SC

InChI

InChI=1S/C20H22N4O2S/c1-26-17-10-8-16(9-11-17)19(25)21-14-18-22-23-20(27-2)24(18)13-12-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H,21,25)