ethyl 4-azanyl-5-(3,5-ditert-butyl-4-oxidanyl-phenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-5-(3,5-ditert-butyl-4-oxidanyl-phenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-5-(3,5-ditert-butyl-4-hydroxy-phenyl)-7-methyl-2-thioxo-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-(3,5-ditert-butyl-4-hydroxyphenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-(3,5-ditert-butyl-4-hydroxyphenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-(3,5-ditert-butyl-4-hydroxy-phenyl)-7-methyl-2-thioxo-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=NC(=S)NC(=C2C1C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)N)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=NC(=S)NC(=C2C1C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)N)C

InChI

InChI=1S/C25H34N4O3S/c1-9-32-22(31)16-12(2)27-21-18(20(26)28-23(33)29-21)17(16)13-10-14(24(3,4)5)19(30)15(11-13)25(6,7)8/h10-11,17,30H,9H2,1-8H3,(H4,26,27,28,29,33)