methyl 2-[(3-methyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanylmethyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(3-methyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanylmethyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(3-methyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanylmethyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[(3-methyl-4-oxo-2-thieno[3,2-d]pyrimidinyl)thio]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-methyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanylmethyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[[(4-keto-3-methyl-thieno[3,2-d]pyrimidin-2-yl)thio]methyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C25H19N3O3S2 MolecularWeight: 473.56666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=CS2)N=C1SCC3=NC4=CC=CC=C4C(=C3C(=O)OC)C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=C(C=CS2)N=C1SCC3=NC4=CC=CC=C4C(=C3C(=O)OC)C5=CC=CC=C5

InChI

InChI=1S/C25H19N3O3S2/c1-28-23(29)22-18(12-13-32-22)27-25(28)33-14-19-21(24(30)31-2)20(15-8-4-3-5-9-15)16-10-6-7-11-17(16)26-19/h3-13H,14H2,1-2H3