2-[(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylmethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylmethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanylmethyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(7-methoxy-4-phenyl-2-quinolinyl)thio]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(7-methoxy-4-phenylquinolin-2-yl)sulfanylmethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(7-methoxy-4-phenyl-2-quinolyl)thio]methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C27H19N3O2S3 MolecularWeight: 513.65366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3)C6=CC=CC=C6

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3)C6=CC=CC=C6

InChI

InChI=1S/C27H19N3O2S3/c1-32-17-9-10-18-19(16-6-3-2-4-7-16)13-24(28-21(18)12-17)34-15-23-29-26(31)25-20(14-35-27(25)30-23)22-8-5-11-33-22/h2-14H,15H2,1H3,(H,29,30,31)