ethyl 4-(5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidin-6-yl)carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidin-6-yl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(5-methyl-4-oxo-3-propyl-thieno[2,3-d]pyrimidine-6-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(5-methyl-4-oxo-3-propyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-methyl-4-oxo-3-propylthieno[2,3-d]pyrimidine-6-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(4-keto-5-methyl-3-propyl-thieno[2,3-d]pyrimidine-6-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCN(CC3)C(=O)OCC)C

Isomeric SMILES

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCN(CC3)C(=O)OCC)C

InChI

InChI=1S/C18H24N4O4S/c1-4-6-22-11-19-15-13(16(22)23)12(3)14(27-15)17(24)20-7-9-21(10-8-20)18(25)26-5-2/h11H,4-10H2,1-3H3