2-[3-methyl-5-[(4-methylphenyl)carbonylamino]pyrazol-1-yl]ethyl 4-methylbenzoate

Systemtic Name: 2-[3-methyl-5-[(4-methylphenyl)carbonylamino]pyrazol-1-yl]ethyl 4-methylbenzoate Openeye Name: 2-[3-methyl-5-[(4-methylbenzoyl)amino]pyrazol-1-yl]ethyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid 2-[3-methyl-5-[[(4-methylphenyl)-oxomethyl]amino]-1-pyrazolyl]ethyl ester IUPAC Name: 2-[3-methyl-5-[(4-methylbenzoyl)amino]pyrazol-1-yl]ethyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 2-[3-methyl-5-(p-toluoylamino)pyrazol-1-yl]ethyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC(=NN2CCOC(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC(=NN2CCOC(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H23N3O3/c1-15-4-8-18(9-5-15)21(26)23-20-14-17(3)24-25(20)12-13-28-22(27)19-10-6-16(2)7-11-19/h4-11,14H,12-13H2,1-3H3,(H,23,26)