ethyl 2,5-dimethyl-4-(3-oxidanylidenepiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-(3-oxidanylidenepiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-(3-oxopiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2,5-dimethyl-4-(3-oxo-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-(3-oxopiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(3-ketopiperazino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)N3CCNC(=O)C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)N3CCNC(=O)C3)C

InChI

InChI=1S/C15H18N4O3S/c1-4-22-15(21)12-8(2)11-13(17-9(3)18-14(11)23-12)19-6-5-16-10(20)7-19/h4-7H2,1-3H3,(H,16,20)