5-(4-bromophenyl)-N-tert-butyl-1-(2-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-tert-butyl-1-(2-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide Openeye Name: 5-(4-bromophenyl)-N-tert-butyl-1-(2-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide CAS Name: 5-(4-bromophenyl)-N-tert-butyl-1-(2-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-3-pyrazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-N-tert-butyl-1-(2-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide Traditional Name: 5-(4-bromophenyl)-N-tert-butyl-1-(2-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide Formula: C23H22BrClN6O MolecularWeight: 513.81738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=NN(C(=C1CN2C=NC=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=NN(C(=C1CN2C=NC=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H22BrClN6O/c1-23(2,3)28-22(32)20-17(12-30-14-26-13-27-30)21(15-8-10-16(24)11-9-15)31(29-20)19-7-5-4-6-18(19)25/h4-11,13-14H,12H2,1-3H3,(H,28,32)