N-cyclopropyl-2-[4-[[4-methyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[[4-methyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[(3-benzyl-4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-N-cyclopropyl-acetamide CAS Name: N-cyclopropyl-2-[4-[[4-methyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinyl]acetamide IUPAC Name: 2-[4-[(3-benzyl-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-[(3-benzyl-4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazino]-N-cyclopropyl-acetamide Formula: C20H28N6OS MolecularWeight: 400.54092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCN(CC2)CC(=O)NC3CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCN(CC2)CC(=O)NC3CC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H28N6OS/c1-23-18(13-16-5-3-2-4-6-16)22-26(20(23)28)15-25-11-9-24(10-12-25)14-19(27)21-17-7-8-17/h2-6,17H,7-15H2,1H3,(H,21,27)