2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=O)N=C(N2)SCC(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=O)N=C(N2)SCC(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C20H20N4O2S/c1-12-9-13(2)21-18-17(12)19(26)23-20(22-18)27-11-16(25)24-8-7-14-5-3-4-6-15(14)10-24/h3-6,9H,7-8,10-11H2,1-2H3,(H,21,22,23,26)