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

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

CC1=NN(C(=S)N1CC2=CC=CC=C2)CN3CCN(CC3)CC(=O)NC4CC4

Isomeric SMILES

CC1=NN(C(=S)N1CC2=CC=CC=C2)CN3CCN(CC3)CC(=O)NC4CC4

InChI

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