ethyl 2-[3,5-dimethyl-4-[(4-methylphenyl)carbonylamino]pyrazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[3,5-dimethyl-4-[(4-methylphenyl)carbonylamino]pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[3,5-dimethyl-4-[(4-methylbenzoyl)amino]pyrazol-1-yl]acetate CAS Name: 2-[3,5-dimethyl-4-[[(4-methylphenyl)-oxomethyl]amino]-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3,5-dimethyl-4-[(4-methylbenzoyl)amino]pyrazol-1-yl]acetate Traditional Name: 2-[3,5-dimethyl-4-(p-toluoylamino)pyrazol-1-yl]acetic acid ethyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(C(=N1)C)NC(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)CN1C(=C(C(=N1)C)NC(=O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C17H21N3O3/c1-5-23-15(21)10-20-13(4)16(12(3)19-20)18-17(22)14-8-6-11(2)7-9-14/h6-9H,5,10H2,1-4H3,(H,18,22)