propan-2-yl 4-azanyl-5-(3-methoxy-4-propoxy-phenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: propan-2-yl 4-azanyl-5-(3-methoxy-4-propoxy-phenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 4-amino-5-(3-methoxy-4-propoxy-phenyl)-7-methyl-2-thioxo-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-(3-methoxy-4-propoxyphenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-amino-5-(3-methoxy-4-propoxyphenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-(3-methoxy-4-propoxy-phenyl)-7-methyl-2-thioxo-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C3=C(NC(=S)N=C3NC(=C2C(=O)OC(C)C)C)N)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2C3=C(NC(=S)N=C3NC(=C2C(=O)OC(C)C)C)N)OC

InChI

InChI=1S/C22H28N4O4S/c1-6-9-29-14-8-7-13(10-15(14)28-5)17-16(21(27)30-11(2)3)12(4)24-20-18(17)19(23)25-22(31)26-20/h7-8,10-11,17H,6,9H2,1-5H3,(H4,23,24,25,26,31)