[4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cycloheptyl]methanamine

Systemtic Name: [4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cycloheptyl]methanamine Openeye Name: [4-[3-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]cycloheptyl]methanamine CAS Name: [4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cycloheptyl]methanamine IUPAC Name: [4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cycloheptyl]methanamine Traditional Name: [4-[3-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]cycloheptyl]methylamine Formula: C22H25ClN4 MolecularWeight: 380.9137

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC(C1)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4)CN

Isomeric SMILES

C1CC(CCC(C1)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4)CN

InChI

InChI=1S/C22H25ClN4/c23-19-8-6-18(7-9-19)22-20(16-10-12-25-13-11-16)21(26-27-22)17-3-1-2-15(14-24)4-5-17/h6-13,15,17H,1-5,14,24H2,(H,26,27)