N-[2-(azepan-1-yl)ethyl]-3-(4-chlorophenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-3-(4-chlorophenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-3-(4-chlorophenyl)-1H-pyrazole-5-carboxamide CAS Name: N-[2-(1-azepanyl)ethyl]-3-(4-chlorophenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-3-(4-chlorophenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-3-(4-chlorophenyl)-1H-pyrazole-5-carboxamide Formula: C18H23ClN4O MolecularWeight: 346.85442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)CCNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H23ClN4O/c19-15-7-5-14(6-8-15)16-13-17(22-21-16)18(24)20-9-12-23-10-3-1-2-4-11-23/h5-8,13H,1-4,9-12H2,(H,20,24)(H,21,22)