2-(4-methylpyrimidin-2-yl)sulfanyl-1-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-methylpyrimidin-2-yl)sulfanyl-1-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-methylpyrimidin-2-yl)sulfanyl-1-(4-tetralin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(4-methyl-2-pyrimidinyl)thio]-1-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-methylpyrimidin-2-yl)sulfanyl-1-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-methylpyrimidin-2-yl)thio]-1-(4-tetralin-2-ylpiperazino)ethanone Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC(=O)N2CCN(CC2)C3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=NC(=NC=C1)SCC(=O)N2CCN(CC2)C3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H26N4OS/c1-16-8-9-22-21(23-16)27-15-20(26)25-12-10-24(11-13-25)19-7-6-17-4-2-3-5-18(17)14-19/h2-5,8-9,19H,6-7,10-15H2,1H3