N-cyclopropyl-N-[(4-methylphenyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-cyclopropyl-N-[(4-methylphenyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-cyclopropyl-N-(p-tolylmethyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-cyclopropyl-N-[(4-methylphenyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-cyclopropyl-N-[(4-methylphenyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-cyclopropyl-N-(4-methylbenzyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C20H22N4OS2 MolecularWeight: 398.54488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2CC2)C(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2CC2)C(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C20H22N4OS2/c1-14-4-6-15(7-5-14)13-24(16-8-9-16)18(25)10-11-23-19(21-22-20(23)26)17-3-2-12-27-17/h2-7,12,16H,8-11,13H2,1H3,(H,22,26)