methoxy-[(5S)-7-methyl-4-oxidanylidene-5-(3-phenoxyphenyl)-2-sulfanylidene-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate

Systemtic Name: methoxy-[(5S)-7-methyl-4-oxidanylidene-5-(3-phenoxyphenyl)-2-sulfanylidene-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate Openeye Name: methoxy-[(5S)-7-methyl-4-oxo-5-(3-phenoxyphenyl)-2-thioxo-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate CAS Name: methoxy-[(5S)-7-methyl-4-oxo-5-(3-phenoxyphenyl)-2-sulfanylidene-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate IUPAC Name: methoxy-[(5S)-7-methyl-4-oxo-5-(3-phenoxyphenyl)-2-sulfanylidene-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]methanolate Traditional Name: [(5S)-4-keto-7-methyl-5-(3-phenoxyphenyl)-2-thioxo-1,5-dihydropyrido[2,3-d]pyrimidin-6-ylidene]-methoxy-methanolate Formula: C22H18N3O4S- MolecularWeight: 420.46102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1=C([O-])OC)C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)NC(=S)N2

Isomeric SMILES

CC1=NC2=C([C@H](C1=C([O-])OC)C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)NC(=S)N2

InChI

InChI=1S/C22H19N3O4S/c1-12-16(21(27)28-2)17(18-19(23-12)24-22(30)25-20(18)26)13-7-6-10-15(11-13)29-14-8-4-3-5-9-14/h3-11,17,27H,1-2H3,(H2,24,25,26,30)/p-1/t17-/m0/s1