ethyl 4-[[2-(dipropylamino)-2-oxidanylidene-ethyl]amino]-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[[2-(dipropylamino)-2-oxidanylidene-ethyl]amino]-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[[2-(dipropylamino)-2-oxo-ethyl]amino]-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[[2-(dipropylamino)-2-oxoethyl]amino]-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(dipropylamino)-2-oxoethyl]amino]-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[[2-(dipropylamino)-2-keto-ethyl]amino]-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CNC1=NC(=NC=C1C(=O)OCC)C2=CC=CC=C2

Isomeric SMILES

CCCN(CCC)C(=O)CNC1=NC(=NC=C1C(=O)OCC)C2=CC=CC=C2

InChI

InChI=1S/C21H28N4O3/c1-4-12-25(13-5-2)18(26)15-23-20-17(21(27)28-6-3)14-22-19(24-20)16-10-8-7-9-11-16/h7-11,14H,4-6,12-13,15H2,1-3H3,(H,22,23,24)