ethyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-[2-[benzyl(isopropyl)amino]-2-oxo-ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-[benzyl(propan-2-yl)amino]-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-[benzyl(isopropyl)amino]-2-keto-ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC(=O)N(CC3=CC=CC=C3)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC(=O)N(CC3=CC=CC=C3)C(C)C)C

InChI

InChI=1S/C22H25N3O4S/c1-5-29-22(28)19-15(4)18-20(30-19)23-13-24(21(18)27)12-17(26)25(14(2)3)11-16-9-7-6-8-10-16/h6-10,13-14H,5,11-12H2,1-4H3