phenyl N-[5-azanyl-3-tert-butyl-1-(2,4-dimethylphenyl)pyrazol-4-yl]carbamate

Systemtic Name: phenyl N-[5-azanyl-3-tert-butyl-1-(2,4-dimethylphenyl)pyrazol-4-yl]carbamate Openeye Name: phenyl N-[5-amino-3-tert-butyl-1-(2,4-dimethylphenyl)pyrazol-4-yl]carbamate CAS Name: N-[5-amino-3-tert-butyl-1-(2,4-dimethylphenyl)-4-pyrazolyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[5-amino-3-tert-butyl-1-(2,4-dimethylphenyl)pyrazol-4-yl]carbamate Traditional Name: N-[5-amino-3-tert-butyl-1-(2,4-dimethylphenyl)pyrazol-4-yl]carbamic acid phenyl ester Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C(C(=N2)C(C)(C)C)NC(=O)OC3=CC=CC=C3)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C(C(=N2)C(C)(C)C)NC(=O)OC3=CC=CC=C3)N)C

InChI

InChI=1S/C22H26N4O2/c1-14-11-12-17(15(2)13-14)26-20(23)18(19(25-26)22(3,4)5)24-21(27)28-16-9-7-6-8-10-16/h6-13H,23H2,1-5H3,(H,24,27)