N-(azepan-1-ylsulfonyl)-5-(4-chlorophenyl)-N-methyl-4-phenyl-3,4-dihydropyrazole-2-carboxamide

Systemtic Name: N-(azepan-1-ylsulfonyl)-5-(4-chlorophenyl)-N-methyl-4-phenyl-3,4-dihydropyrazole-2-carboxamide Openeye Name: N-(azepan-1-ylsulfonyl)-5-(4-chlorophenyl)-N-methyl-4-phenyl-3,4-dihydropyrazole-2-carboxamide CAS Name: N-(1-azepanylsulfonyl)-5-(4-chlorophenyl)-N-methyl-4-phenyl-3,4-dihydropyrazole-2-carboxamide IUPAC Name: N-(azepan-1-ylsulfonyl)-5-(4-chlorophenyl)-N-methyl-4-phenyl-3,4-dihydropyrazole-2-carboxamide Traditional Name: N-(azepan-1-ylsulfonyl)-3-(4-chlorophenyl)-N-methyl-4-phenyl-2-pyrazoline-1-carboxamide Formula: C23H27ClN4O3S MolecularWeight: 475.00348

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)N1CC(C(=N1)C2=CC=C(C=C2)Cl)C3=CC=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CN(C(=O)N1CC(C(=N1)C2=CC=C(C=C2)Cl)C3=CC=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H27ClN4O3S/c1-26(32(30,31)27-15-7-2-3-8-16-27)23(29)28-17-21(18-9-5-4-6-10-18)22(25-28)19-11-13-20(24)14-12-19/h4-6,9-14,21H,2-3,7-8,15-17H2,1H3