ethyl 4-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methylamino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]acetyl]amino]benzoic acid ethyl ester Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C24H28N4O3/c1-5-31-24(30)19-11-13-20(14-12-19)25-23(29)16-27(4)15-22-17(2)26-28(18(22)3)21-9-7-6-8-10-21/h6-14H,5,15-16H2,1-4H3,(H,25,29)