5-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-7-phenyl-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-7-phenyl-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-hydroxy-3-methoxy-5-nitro-phenyl)-7-phenyl-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 5-(4-hydroxy-3-methoxy-5-nitrophenyl)-7-phenyl-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-hydroxy-3-methoxy-5-nitrophenyl)-7-phenyl-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-hydroxy-3-methoxy-5-nitro-phenyl)-7-phenyl-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C20H16N4O5S MolecularWeight: 424.42984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C2C=C(NC3=C2C(=O)NC(=S)N3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])C2C=C(NC3=C2C(=O)NC(=S)N3)C4=CC=CC=C4

InChI

InChI=1S/C20H16N4O5S/c1-29-15-8-11(7-14(17(15)25)24(27)28)12-9-13(10-5-3-2-4-6-10)21-18-16(12)19(26)23-20(30)22-18/h2-9,12,25H,1H3,(H3,21,22,23,26,30)