ethyl 6-[(Z)-[diethylamino-[(4-methylphenyl)amino]methylidene]amino]-2-morpholin-4-yl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(Z)-[diethylamino-[(4-methylphenyl)amino]methylidene]amino]-2-morpholin-4-yl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(Z)-[diethylamino-(4-methylanilino)methylene]amino]-2-morpholino-4-oxo-3-phenyl-thieno[2,3-d]pyrimidine-5-carboxylate CAS Name: 6-[(Z)-[diethylamino-(4-methylanilino)methylidene]amino]-2-(4-morpholinyl)-4-oxo-3-phenyl-5-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[(Z)-[diethylamino-(4-methylanilino)methylidene]amino]-2-morpholin-4-yl-4-oxo-3-phenylthieno[2,3-d]pyrimidine-5-carboxylate Traditional Name: 6-[(Z)-[diethylamino(p-toluidino)methylene]amino]-4-keto-2-morpholino-3-phenyl-thieno[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C31H36N6O4S MolecularWeight: 588.72034

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=NC1=C(C2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)N4CCOCC4)C(=O)OCC)NC5=CC=C(C=C5)C

Isomeric SMILES

CCN(CC)/C(=N\C1=C(C2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)N4CCOCC4)C(=O)OCC)/NC5=CC=C(C=C5)C

InChI

InChI=1S/C31H36N6O4S/c1-5-35(6-2)30(32-22-15-13-21(4)14-16-22)33-27-25(29(39)41-7-3)24-26(42-27)34-31(36-17-19-40-20-18-36)37(28(24)38)23-11-9-8-10-12-23/h8-16H,5-7,17-20H2,1-4H3,(H,32,33)