N,N-diethyl-2-[(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylmethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N,N-diethyl-2-[(7-methoxy-4-phenyl-quinolin-2-yl)sulfanylmethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N,N-diethyl-2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N,N-diethyl-2-[[(7-methoxy-4-phenyl-2-quinolinyl)thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: N,N-diethyl-2-[(7-methoxy-4-phenylquinolin-2-yl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N,N-diethyl-4-keto-2-[[(7-methoxy-4-phenyl-2-quinolyl)thio]methyl]-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C29H28N4O3S2 MolecularWeight: 544.68762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC3=NC4=C(C=CC(=C4)OC)C(=C3)C5=CC=CC=C5)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC3=NC4=C(C=CC(=C4)OC)C(=C3)C5=CC=CC=C5)C

InChI

InChI=1S/C29H28N4O3S2/c1-5-33(6-2)29(35)26-17(3)25-27(34)31-23(32-28(25)38-26)16-37-24-15-21(18-10-8-7-9-11-18)20-13-12-19(36-4)14-22(20)30-24/h7-15H,5-6,16H2,1-4H3,(H,31,32,34)