propan-2-yl 7-methyl-4-oxidanylidene-2-prop-2-enylsulfanyl-5-pyridin-4-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: propan-2-yl 7-methyl-4-oxidanylidene-2-prop-2-enylsulfanyl-5-pyridin-4-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 2-allylsulfanyl-7-methyl-4-oxo-5-(4-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 7-methyl-4-oxo-2-(prop-2-enylthio)-5-pyridin-4-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 7-methyl-4-oxo-2-prop-2-enylsulfanyl-5-pyridin-4-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(allylthio)-4-keto-7-methyl-5-(4-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)NC(=NC2=O)SCC=C)C3=CC=NC=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(C2=C(N1)NC(=NC2=O)SCC=C)C3=CC=NC=C3)C(=O)OC(C)C

InChI

InChI=1S/C20H22N4O3S/c1-5-10-28-20-23-17-16(18(25)24-20)15(13-6-8-21-9-7-13)14(12(4)22-17)19(26)27-11(2)3/h5-9,11,15H,1,10H2,2-4H3,(H2,22,23,24,25)