ethyl N-[(ethoxycarbonylamino)-[1-phenyl-3-(4-propan-2-ylphenyl)pyrazol-4-yl]methyl]carbamate

Systemtic Name: ethyl N-[(ethoxycarbonylamino)-[1-phenyl-3-(4-propan-2-ylphenyl)pyrazol-4-yl]methyl]carbamate Openeye Name: ethyl N-[(ethoxycarbonylamino)-[3-(4-isopropylphenyl)-1-phenyl-pyrazol-4-yl]methyl]carbamate CAS Name: N-[(ethoxycarbonylamino)-[1-phenyl-3-(4-propan-2-ylphenyl)-4-pyrazolyl]methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(ethoxycarbonylamino)-[1-phenyl-3-(4-propan-2-ylphenyl)pyrazol-4-yl]methyl]carbamate Traditional Name: N-[(carbethoxyamino)-(3-p-cumenyl-1-phenyl-pyrazol-4-yl)methyl]carbamic acid ethyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C1=CN(N=C1C2=CC=C(C=C2)C(C)C)C3=CC=CC=C3)NC(=O)OCC

Isomeric SMILES

CCOC(=O)NC(C1=CN(N=C1C2=CC=C(C=C2)C(C)C)C3=CC=CC=C3)NC(=O)OCC

InChI

InChI=1S/C25H30N4O4/c1-5-32-24(30)26-23(27-25(31)33-6-2)21-16-29(20-10-8-7-9-11-20)28-22(21)19-14-12-18(13-15-19)17(3)4/h7-17,23H,5-6H2,1-4H3,(H,26,30)(H,27,31)