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

Systemtic Name: 3-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylprop-2-ynyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one Openeye Name: 3-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylprop-2-ynyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one CAS Name: 3-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylprop-2-ynyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one IUPAC Name: 3-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylprop-2-ynyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one Traditional Name: 3-(4-mesylbenzyl)-6-(3-phenylprop-2-ynyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one Formula: C24H23N3O3S MolecularWeight: 433.52272

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)CN(CC3)CC#CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)CN(CC3)CC#CC4=CC=CC=C4

InChI

InChI=1S/C24H23N3O3S/c1-31(29,30)21-11-9-20(10-12-21)16-27-18-25-23-13-15-26(17-22(23)24(27)28)14-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-12,18H,13-17H2,1H3