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

Systemtic Name: 5-(4-bromophenyl)-1-(2-chlorophenyl)-N-cycloheptyl-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide Openeye Name: 5-(4-bromophenyl)-1-(2-chlorophenyl)-N-cycloheptyl-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide CAS Name: 5-(4-bromophenyl)-1-(2-chlorophenyl)-N-cycloheptyl-4-(1,2,4-triazol-1-ylmethyl)-3-pyrazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-1-(2-chlorophenyl)-N-cycloheptyl-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide Traditional Name: 5-(4-bromophenyl)-1-(2-chlorophenyl)-N-cycloheptyl-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide Formula: C26H26BrClN6O MolecularWeight: 553.88124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=NN(C(=C2CN3C=NC=N3)C4=CC=C(C=C4)Br)C5=CC=CC=C5Cl

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=NN(C(=C2CN3C=NC=N3)C4=CC=C(C=C4)Br)C5=CC=CC=C5Cl

InChI

InChI=1S/C26H26BrClN6O/c27-19-13-11-18(12-14-19)25-21(15-33-17-29-16-30-33)24(26(35)31-20-7-3-1-2-4-8-20)32-34(25)23-10-6-5-9-22(23)28/h5-6,9-14,16-17,20H,1-4,7-8,15H2,(H,31,35)