1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethanone

Systemtic Name: 1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethanone Openeye Name: 1-[3-methyl-4-(m-tolyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)ethanone CAS Name: 1-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethanone IUPAC Name: 1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)ethanone Traditional Name: 1-[3-methyl-4-(m-tolyl)piperazino]-2-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)ethanone Formula: C21H32N4OS MolecularWeight: 388.56998

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(NC(=S)N1CC(=O)N2CCN(C(C2)C)C3=CC=CC(=C3)C)(C)C

Isomeric SMILES

CC1CC(NC(=S)N1CC(=O)N2CCN(C(C2)C)C3=CC=CC(=C3)C)(C)C

InChI

InChI=1S/C21H32N4OS/c1-15-7-6-8-18(11-15)24-10-9-23(13-17(24)3)19(26)14-25-16(2)12-21(4,5)22-20(25)27/h6-8,11,16-17H,9-10,12-14H2,1-5H3,(H,22,27)