ethyl 6-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(1,3-diphenyl-4-pyrazolyl)methyl-methylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[(1,3-diphenylpyrazol-4-yl)methyl-methylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CN(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CN(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N5O3/c1-3-33-24(31)21-14-26-25(32)27-22(21)17-29(2)15-19-16-30(20-12-8-5-9-13-20)28-23(19)18-10-6-4-7-11-18/h4-13,16H,3,14-15,17H2,1-2H3,(H2,26,27,32)