6-methyl-2-[2-oxidanylidene-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-[2-oxidanylidene-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 2-[2-[4-[(E)-cinnamyl]piperazin-1-yl]-2-oxo-ethyl]sulfanyl-6-methyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-[[2-oxo-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-[2-oxo-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-[4-[(E)-cinnamyl]piperazino]-2-keto-ethyl]thio]-6-methyl-1H-pyrimidin-4-one Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC(=O)N2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC(=O)N2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H24N4O2S/c1-16-14-18(25)22-20(21-16)27-15-19(26)24-12-10-23(11-13-24)9-5-8-17-6-3-2-4-7-17/h2-8,14H,9-13,15H2,1H3,(H,21,22,25)/b8-5+