6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[(4-methylsulfanylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one

Systemtic Name: 6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[(4-methylsulfanylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one Openeye Name: 6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[(4-methylsulfanylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one CAS Name: 6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[[4-(methylthio)phenyl]methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one IUPAC Name: 6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[(4-methylsulfanylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one Traditional Name: 6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[4-(methylthio)benzyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CCN2CCC3=C(C2)C(=O)N(C=N3)CC4=CC=C(C=C4)SC

Isomeric SMILES

COC1=CC=C(C=C1)C#CCN2CCC3=C(C2)C(=O)N(C=N3)CC4=CC=C(C=C4)SC

InChI

InChI=1S/C25H25N3O2S/c1-30-21-9-5-19(6-10-21)4-3-14-27-15-13-24-23(17-27)25(29)28(18-26-24)16-20-7-11-22(31-2)12-8-20/h5-12,18H,13-17H2,1-2H3