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

Systemtic Name: 6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[(4-methylsulfonylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one Openeye Name: 6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[(4-methylsulfonylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one CAS Name: 6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[(4-methylsulfonylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one IUPAC Name: 6-[3-(4-methoxyphenyl)prop-2-ynyl]-3-[(4-methylsulfonylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one Traditional Name: 3-(4-mesylbenzyl)-6-[3-(4-methoxyphenyl)prop-2-ynyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one Formula: C25H25N3O4S MolecularWeight: 463.5487

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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)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O4S/c1-32-21-9-5-19(6-10-21)4-3-14-27-15-13-24-23(17-27)25(29)28(18-26-24)16-20-7-11-22(12-8-20)33(2,30)31/h5-12,18H,13-17H2,1-2H3