3-[[5-[3-(4-methoxy-3-methyl-phenyl)propyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide

Systemtic Name: 3-[[5-[3-(4-methoxy-3-methyl-phenyl)propyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: 3-[[5-[3-(4-methoxy-3-methyl-phenyl)propyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide CAS Name: 3-[[5-[3-(4-methoxy-3-methylphenyl)propyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-N-phenylpropanamide IUPAC Name: 3-[[5-[3-(4-methoxy-3-methylphenyl)propyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylpropanamide Traditional Name: 3-[[5-[3-(4-methoxy-3-methyl-phenyl)propyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-N-phenyl-propionamide Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCCC2=NN=C(N2C3=CC=CC=C3)SCCC(=O)NC4=CC=CC=C4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CCCC2=NN=C(N2C3=CC=CC=C3)SCCC(=O)NC4=CC=CC=C4)OC

InChI

InChI=1S/C28H30N4O2S/c1-21-20-22(16-17-25(21)34-2)10-9-15-26-30-31-28(32(26)24-13-7-4-8-14-24)35-19-18-27(33)29-23-11-5-3-6-12-23/h3-8,11-14,16-17,20H,9-10,15,18-19H2,1-2H3,(H,29,33)