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

Systemtic Name: ethyl 4-(cycloheptylamino)-2-(2-methoxy-2-oxidanylidene-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(cycloheptylamino)-2-(2-methoxy-2-oxo-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(cycloheptylamino)-2-(2-methoxy-2-oxoethyl)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cycloheptylamino)-2-(2-methoxy-2-oxoethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(cycloheptylamino)-2-(2-keto-2-methoxy-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CC(=O)OC)NC3CCCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CC(=O)OC)NC3CCCCCC3)C

InChI

InChI=1S/C20H27N3O4S/c1-4-27-20(25)17-12(2)16-18(21-13-9-7-5-6-8-10-13)22-14(11-15(24)26-3)23-19(16)28-17/h13H,4-11H2,1-3H3,(H,21,22,23)