3-[[5-(methoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)propanamide

Systemtic Name: 3-[[5-(methoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)propanamide Openeye Name: 3-[[5-(methoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(p-tolyl)propanamide CAS Name: 3-[[5-(methoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(4-methylphenyl)propanamide IUPAC Name: 3-[[5-(methoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)propanamide Traditional Name: 3-[[5-(methoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(p-tolyl)propionamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCSC2=NN=C(N2C3=CC=CC=C3)COC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCSC2=NN=C(N2C3=CC=CC=C3)COC

InChI

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