1-(3-chlorophenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-5-propan-2-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(3-chlorophenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-5-propan-2-yl-pyrazole-4-carboxamide Openeye Name: 1-(3-chlorophenyl)-5-isopropyl-N-[3-(2-oxoazepan-1-yl)propyl]pyrazole-4-carboxamide CAS Name: 1-(3-chlorophenyl)-N-[3-(2-oxo-1-azepanyl)propyl]-5-propan-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-(3-chlorophenyl)-N-[3-(2-oxoazepan-1-yl)propyl]-5-propan-2-ylpyrazole-4-carboxamide Traditional Name: 1-(3-chlorophenyl)-5-isopropyl-N-[3-(2-ketoazepan-1-yl)propyl]pyrazole-4-carboxamide Formula: C22H29ClN4O2 MolecularWeight: 416.94426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCCCN3CCCCCC3=O

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCCCN3CCCCCC3=O

InChI

InChI=1S/C22H29ClN4O2/c1-16(2)21-19(15-25-27(21)18-9-6-8-17(23)14-18)22(29)24-11-7-13-26-12-5-3-4-10-20(26)28/h6,8-9,14-16H,3-5,7,10-13H2,1-2H3,(H,24,29)