N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methyl]-N-methyl-2-(2-oxidanylideneazepan-1-yl)ethanamide

Systemtic Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methyl]-N-methyl-2-(2-oxidanylideneazepan-1-yl)ethanamide Openeye Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methyl]-N-methyl-2-(2-oxoazepan-1-yl)acetamide CAS Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-4-pyrazolyl]methyl]-N-methyl-2-(2-oxo-1-azepanyl)acetamide IUPAC Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenylpyrazol-4-yl]methyl]-N-methyl-2-(2-oxoazepan-1-yl)acetamide Traditional Name: N-[[1-(2-chlorobenzyl)-3-phenyl-pyrazol-4-yl]methyl]-2-(2-ketoazepan-1-yl)-N-methyl-acetamide Formula: C26H29ClN4O2 MolecularWeight: 464.98706

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3Cl)C(=O)CN4CCCCCC4=O

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3Cl)C(=O)CN4CCCCCC4=O

InChI

InChI=1S/C26H29ClN4O2/c1-29(25(33)19-30-15-9-3-6-14-24(30)32)16-22-18-31(17-21-12-7-8-13-23(21)27)28-26(22)20-10-4-2-5-11-20/h2,4-5,7-8,10-13,18H,3,6,9,14-17,19H2,1H3