2-methyl-1-[4-[[3-methyl-4-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[[3-methyl-4-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[(4-benzyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 2-methyl-1-[4-[[3-methyl-4-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-[(4-benzyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[(4-benzyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazino]-2-methyl-propan-1-one Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N5OS/c1-15(2)18(25)22-11-9-21(10-12-22)14-24-19(26)23(16(3)20-24)13-17-7-5-4-6-8-17/h4-8,15H,9-14H2,1-3H3