ethyl 5-methyl-3-[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-3-[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-3-[2-oxo-2-(p-tolylmethylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-3-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-[(4-methylbenzyl)amino]ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC(=O)NCC3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC(=O)NCC3=CC=C(C=C3)C)C

InChI

InChI=1S/C20H21N3O4S/c1-4-27-20(26)17-13(3)16-18(28-17)22-11-23(19(16)25)10-15(24)21-9-14-7-5-12(2)6-8-14/h5-8,11H,4,9-10H2,1-3H3,(H,21,24)