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

Systemtic Name: 2-[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-keto-1-methyl-2-(4-phenylpiperazino)ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H26N4O2S/c1-3-7-16-14-18(25)22-20(21-16)27-15(2)19(26)24-12-10-23(11-13-24)17-8-5-4-6-9-17/h4-6,8-9,14-15H,3,7,10-13H2,1-2H3,(H,21,22,25)