2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1H-pyrimidin-4-one

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1H-pyrimidin-4-one Openeye Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-[4-(m-tolyl)piperazin-1-yl]-2-oxo-ethyl]-1H-pyrimidin-4-one CAS Name: 2-[(3-methoxyphenyl)methylthio]-6-[2-[4-(3-methylphenyl)-1-piperazinyl]-2-oxoethyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl]-1H-pyrimidin-4-one Traditional Name: 6-[2-keto-2-[4-(m-tolyl)piperazino]ethyl]-2-(m-anisylthio)-1H-pyrimidin-4-one Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CC3=CC(=O)N=C(N3)SCC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CC3=CC(=O)N=C(N3)SCC4=CC(=CC=C4)OC

InChI

InChI=1S/C25H28N4O3S/c1-18-5-3-7-21(13-18)28-9-11-29(12-10-28)24(31)16-20-15-23(30)27-25(26-20)33-17-19-6-4-8-22(14-19)32-2/h3-8,13-15H,9-12,16-17H2,1-2H3,(H,26,27,30)