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

Systemtic Name: 5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-N-[3-(2-oxoazepan-1-yl)propyl]pyrazole-4-carboxamide CAS Name: 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-N-[3-(2-oxo-1-azepanyl)propyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-N-[3-(2-oxoazepan-1-yl)propyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-1-(2-chlorobenzyl)-N-[3-(2-ketoazepan-1-yl)propyl]-3-methyl-pyrazole-4-carboxamide Formula: C21H26Cl2N4O2 MolecularWeight: 437.36274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCCN2CCCCCC2=O)Cl)CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCCN2CCCCCC2=O)Cl)CC3=CC=CC=C3Cl

InChI

InChI=1S/C21H26Cl2N4O2/c1-15-19(20(23)27(25-15)14-16-8-4-5-9-17(16)22)21(29)24-11-7-13-26-12-6-2-3-10-18(26)28/h4-5,8-9H,2-3,6-7,10-14H2,1H3,(H,24,29)