ethoxy-[(5R)-7-(4-nitrophenyl)-4-oxidanylidene-5-phenyl-2-sulfanylidene-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate

Systemtic Name: ethoxy-[(5R)-7-(4-nitrophenyl)-4-oxidanylidene-5-phenyl-2-sulfanylidene-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate Openeye Name: ethoxy-[(5R)-7-(4-nitrophenyl)-4-oxo-5-phenyl-2-thioxo-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate CAS Name: ethoxy-[(5R)-7-(4-nitrophenyl)-4-oxo-5-phenyl-2-sulfanylidene-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate IUPAC Name: ethoxy-[(5R)-7-(4-nitrophenyl)-4-oxo-5-phenyl-2-sulfanylidene-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate Traditional Name: ethoxy-[(5R)-4-keto-7-(4-nitrophenyl)-5-phenyl-2-thioxo-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate Formula: C22H17N4O5S- MolecularWeight: 449.45918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C1C(C2=C(NC(=S)NC2=O)N=C1C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)[O-]

Isomeric SMILES

CCOC(=C1[C@H](C2=C(NC(=S)NC2=O)N=C1C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)[O-]

InChI

InChI=1S/C22H18N4O5S/c1-2-31-21(28)16-15(12-6-4-3-5-7-12)17-19(24-22(32)25-20(17)27)23-18(16)13-8-10-14(11-9-13)26(29)30/h3-11,15,28H,2H2,1H3,(H2,24,25,27,32)/p-1/t15-/m1/s1