5-(4-ethoxy-3-methoxy-phenyl)-1-methyl-2-prop-2-enylsulfanyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione

Systemtic Name: 5-(4-ethoxy-3-methoxy-phenyl)-1-methyl-2-prop-2-enylsulfanyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione Openeye Name: 2-allylsulfanyl-5-(4-ethoxy-3-methoxy-phenyl)-1-methyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione CAS Name: 5-(4-ethoxy-3-methoxyphenyl)-1-methyl-2-(prop-2-enylthio)-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione IUPAC Name: 5-(4-ethoxy-3-methoxyphenyl)-1-methyl-2-prop-2-enylsulfanyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-dione Traditional Name: 2-(allylthio)-5-(4-ethoxy-3-methoxy-phenyl)-1-methyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-4,7-quinone Formula: C20H23N3O4S MolecularWeight: 401.47932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2CC(=O)NC3=C2C(=O)N=C(N3C)SCC=C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2CC(=O)NC3=C2C(=O)N=C(N3C)SCC=C)OC

InChI

InChI=1S/C20H23N3O4S/c1-5-9-28-20-22-19(25)17-13(11-16(24)21-18(17)23(20)3)12-7-8-14(27-6-2)15(10-12)26-4/h5,7-8,10,13H,1,6,9,11H2,2-4H3,(H,21,24)