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

Systemtic Name: propan-2-yl 4-azanyl-7-methyl-5-(3-nitro-4-oxidanyl-phenyl)-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 4-amino-5-(4-hydroxy-3-nitro-phenyl)-7-methyl-2-thioxo-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-(4-hydroxy-3-nitrophenyl)-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-(4-hydroxy-3-nitrophenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-(4-hydroxy-3-nitro-phenyl)-7-methyl-2-thioxo-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C18H19N5O5S MolecularWeight: 417.43896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(NC(=S)N=C2N1)N)C3=CC(=C(C=C3)O)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(C2=C(NC(=S)N=C2N1)N)C3=CC(=C(C=C3)O)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C18H19N5O5S/c1-7(2)28-17(25)12-8(3)20-16-14(15(19)21-18(29)22-16)13(12)9-4-5-11(24)10(6-9)23(26)27/h4-7,13,24H,1-3H3,(H4,19,20,21,22,29)