(4-pyrazol-1-ylphenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C22H24N4O3/c1-16(2)25-22(28)23-14-17-4-8-19(9-5-17)21(27)29-15-18-6-10-20(11-7-18)26-13-3-12-24-26/h3-13,16H,14-15H2,1-2H3,(H2,23,25,28)