7-methyl-4-oxidanylidene-1-[(1R)-1-phenylethyl]-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: 7-methyl-4-oxidanylidene-1-[(1R)-1-phenylethyl]-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate Openeye Name: 7-methyl-4-oxo-1-[(1R)-1-phenylethyl]-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate CAS Name: 7-methyl-4-oxo-1-[(1R)-1-phenylethyl]-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylate IUPAC Name: 7-methyl-4-oxo-1-[(1R)-1-phenylethyl]-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-keto-7-methyl-1-[(1R)-1-phenylethyl]-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate Formula: C17H14N3O3S- MolecularWeight: 340.37636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C(=O)[O-])C(=O)NC(=S)N2C(C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O3S/c1-9-8-12(16(22)23)13-14(18-9)20(17(24)19-15(13)21)10(2)11-6-4-3-5-7-11/h3-8,10H,1-2H3,(H,22,23)(H,19,21,24)/p-1/t10-/m1/s1