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

Systemtic Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclopropyl)methyl]propanamide Openeye Name: 3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclopropyl)methyl]propanamide CAS Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclopropyl)methyl]propanamide IUPAC Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(1-phenylcyclopropyl)methyl]propanamide Traditional Name: N-[(1-phenylcyclopropyl)methyl]-3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propionamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2S/c1-2-29-19-10-8-17(9-11-19)21-25-26-22(30)27(21)15-12-20(28)24-16-23(13-14-23)18-6-4-3-5-7-18/h3-11H,2,12-16H2,1H3,(H,24,28)(H,26,30)