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

Systemtic Name: 3-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 3-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 3-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]propionamide Formula: C18H18N4O2S MolecularWeight: 354.42612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SCCC(=O)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SCCC(=O)N

InChI

InChI=1S/C18H18N4O2S/c1-24-15-9-5-6-13(12-15)17-20-21-18(25-11-10-16(19)23)22(17)14-7-3-2-4-8-14/h2-9,12H,10-11H2,1H3,(H2,19,23)