ethyl 6-[(4-methylphenyl)iminomethylideneamino]-4-oxidanylidene-3-phenyl-2-piperidin-1-yl-thieno[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(4-methylphenyl)iminomethylideneamino]-4-oxidanylidene-3-phenyl-2-piperidin-1-yl-thieno[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-oxo-3-phenyl-2-(1-piperidyl)-6-(p-tolyliminomethyleneamino)thieno[2,3-d]pyrimidine-5-carboxylate CAS Name: 6-[(4-methylphenyl)iminomethylideneamino]-4-oxo-3-phenyl-2-(1-piperidinyl)-5-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-methylphenyl)iminomethylideneamino]-4-oxo-3-phenyl-2-piperidin-1-ylthieno[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-keto-3-phenyl-2-piperidino-6-(p-tolyliminomethyleneamino)thieno[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C28H27N5O3S MolecularWeight: 513.61068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1C(=O)N(C(=N2)N3CCCCC3)C4=CC=CC=C4)N=C=NC5=CC=C(C=C5)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1C(=O)N(C(=N2)N3CCCCC3)C4=CC=CC=C4)N=C=NC5=CC=C(C=C5)C

InChI

InChI=1S/C28H27N5O3S/c1-3-36-27(35)23-22-25(37-24(23)30-18-29-20-14-12-19(2)13-15-20)31-28(32-16-8-5-9-17-32)33(26(22)34)21-10-6-4-7-11-21/h4,6-7,10-15H,3,5,8-9,16-17H2,1-2H3