ethyl 6-methyl-2-[(2R)-2-methyl-5-oxidanylidene-1,4-diazepan-1-yl]pyrimidine-4-carboxylate

Systemtic Name: ethyl 6-methyl-2-[(2R)-2-methyl-5-oxidanylidene-1,4-diazepan-1-yl]pyrimidine-4-carboxylate Openeye Name: ethyl 6-methyl-2-[(2R)-2-methyl-5-oxo-1,4-diazepan-1-yl]pyrimidine-4-carboxylate CAS Name: 6-methyl-2-[(2R)-2-methyl-5-oxo-1,4-diazepan-1-yl]-4-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-2-[(2R)-2-methyl-5-oxo-1,4-diazepan-1-yl]pyrimidine-4-carboxylate Traditional Name: 2-[(2R)-5-keto-2-methyl-1,4-diazepan-1-yl]-6-methyl-pyrimidine-4-carboxylic acid ethyl ester Formula: C14H20N4O3 MolecularWeight: 292.3336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC(=N1)N2CCC(=O)NCC2C)C

Isomeric SMILES

CCOC(=O)C1=CC(=NC(=N1)N2CCC(=O)NC[C@H]2C)C

InChI

InChI=1S/C14H20N4O3/c1-4-21-13(20)11-7-9(2)16-14(17-11)18-6-5-12(19)15-8-10(18)3/h7,10H,4-6,8H2,1-3H3,(H,15,19)/t10-/m1/s1