ethyl 4-(4-methanoylpiperazin-1-yl)-6-methyl-2-thiomorpholin-4-yl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-methanoylpiperazin-1-yl)-6-methyl-2-thiomorpholin-4-yl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-formylpiperazin-1-yl)-6-methyl-2-thiomorpholino-pyrimidine-5-carboxylate CAS Name: 4-(4-formyl-1-piperazinyl)-6-methyl-2-thiomorpholin-4-yl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-formylpiperazin-1-yl)-6-methyl-2-thiomorpholin-4-ylpyrimidine-5-carboxylate Traditional Name: 4-(4-formylpiperazino)-6-methyl-2-thiomorpholino-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H25N5O3S MolecularWeight: 379.4771

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1N2CCN(CC2)C=O)N3CCSCC3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1N2CCN(CC2)C=O)N3CCSCC3)C

InChI

InChI=1S/C17H25N5O3S/c1-3-25-16(24)14-13(2)18-17(22-8-10-26-11-9-22)19-15(14)21-6-4-20(12-23)5-7-21/h12H,3-11H2,1-2H3