2-[8-(4-chlorophenyl)-8-oxidanylidene-octyl]sulfanyl-5-[(1-methyl-2-oxidanylidene-pyridin-4-yl)methyl]-1-(2-pyridin-3-ylethyl)pyrimidin-4-one

Systemtic Name: 2-[8-(4-chlorophenyl)-8-oxidanylidene-octyl]sulfanyl-5-[(1-methyl-2-oxidanylidene-pyridin-4-yl)methyl]-1-(2-pyridin-3-ylethyl)pyrimidin-4-one Openeye Name: 2-[8-(4-chlorophenyl)-8-oxo-octyl]sulfanyl-5-[(1-methyl-2-oxo-4-pyridyl)methyl]-1-[2-(3-pyridyl)ethyl]pyrimidin-4-one CAS Name: 2-[[8-(4-chlorophenyl)-8-oxooctyl]thio]-5-[(1-methyl-2-oxo-4-pyridinyl)methyl]-1-[2-(3-pyridinyl)ethyl]-4-pyrimidinone IUPAC Name: 2-[8-(4-chlorophenyl)-8-oxooctyl]sulfanyl-5-[(1-methyl-2-oxopyridin-4-yl)methyl]-1-(2-pyridin-3-ylethyl)pyrimidin-4-one Traditional Name: 2-[[8-(4-chlorophenyl)-8-keto-octyl]thio]-5-[(2-keto-1-methyl-4-pyridyl)methyl]-1-[2-(3-pyridyl)ethyl]pyrimidin-4-one Formula: C32H35ClN4O3S MolecularWeight: 591.1633

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=CC1=O)CC2=CN(C(=NC2=O)SCCCCCCCC(=O)C3=CC=C(C=C3)Cl)CCC4=CN=CC=C4

Isomeric SMILES

CN1C=CC(=CC1=O)CC2=CN(C(=NC2=O)SCCCCCCCC(=O)C3=CC=C(C=C3)Cl)CCC4=CN=CC=C4

InChI

InChI=1S/C32H35ClN4O3S/c1-36-17-14-25(21-30(36)39)20-27-23-37(18-15-24-8-7-16-34-22-24)32(35-31(27)40)41-19-6-4-2-3-5-9-29(38)26-10-12-28(33)13-11-26/h7-8,10-14,16-17,21-23H,2-6,9,15,18-20H2,1H3