tert-butyl N-[(3-cyanophenyl)methyl]-N-(5-cyano-1-phenyl-pyrazol-4-yl)carbamate

Systemtic Name: tert-butyl N-[(3-cyanophenyl)methyl]-N-(5-cyano-1-phenyl-pyrazol-4-yl)carbamate Openeye Name: tert-butyl N-[(3-cyanophenyl)methyl]-N-(5-cyano-1-phenyl-pyrazol-4-yl)carbamate CAS Name: N-[(3-cyanophenyl)methyl]-N-(5-cyano-1-phenyl-4-pyrazolyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3-cyanophenyl)methyl]-N-(5-cyano-1-phenylpyrazol-4-yl)carbamate Traditional Name: N-(3-cyanobenzyl)-N-(5-cyano-1-phenyl-pyrazol-4-yl)carbamic acid tert-butyl ester Formula: C23H21N5O2 MolecularWeight: 399.44514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC(=C1)C#N)C2=C(N(N=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC(=C1)C#N)C2=C(N(N=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C23H21N5O2/c1-23(2,3)30-22(29)27(16-18-9-7-8-17(12-18)13-24)21-15-26-28(20(21)14-25)19-10-5-4-6-11-19/h4-12,15H,16H2,1-3H3