N-(1,1-diphenylpropan-2-yl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide

Systemtic Name: N-(1,1-diphenylpropan-2-yl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(1-methyl-2,2-diphenyl-ethyl)propanamide CAS Name: N-(1,1-diphenylpropan-2-yl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(1,1-diphenylpropan-2-yl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(1-methyl-2,2-diphenyl-ethyl)-3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propionamide Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC(C)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC(C)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H30N4O2S/c1-3-34-24-16-14-23(15-17-24)27-30-31-28(35)32(27)19-18-25(33)29-20(2)26(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-17,20,26H,3,18-19H2,1-2H3,(H,29,33)(H,31,35)