2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-propoxy-phenyl)methyl]ethanamide

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-propoxy-phenyl)methyl]ethanamide Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-propoxy-phenyl)methyl]acetamide CAS Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-[(3-methoxy-4-propoxyphenyl)methyl]acetamide IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-propoxyphenyl)methyl]acetamide Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(3-methoxy-4-propoxy-benzyl)acetamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H28N4O3S/c1-3-16-34-23-15-14-20(17-24(23)33-2)18-28-25(32)19-35-27-30-29-26(21-10-6-4-7-11-21)31(27)22-12-8-5-9-13-22/h4-15,17H,3,16,18-19H2,1-2H3,(H,28,32)