2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propan-2-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 6-isopropyl-2-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(4-methyl-1-piperazinyl)-2-oxoethyl]thio]-6-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-6-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 6-isopropyl-2-[[2-keto-2-(4-methylpiperazino)ethyl]thio]-1H-pyrimidin-4-one Formula: C14H22N4O2S MolecularWeight: 310.41508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N=C(N1)SCC(=O)N2CCN(CC2)C

Isomeric SMILES

CC(C)C1=CC(=O)N=C(N1)SCC(=O)N2CCN(CC2)C

InChI

InChI=1S/C14H22N4O2S/c1-10(2)11-8-12(19)16-14(15-11)21-9-13(20)18-6-4-17(3)5-7-18/h8,10H,4-7,9H2,1-3H3,(H,15,16,19)