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

Systemtic Name: N-(azepan-1-ylsulfonyl)-5-(4-chlorophenyl)-N'-methyl-4-phenyl-3,4-dihydropyrazole-2-carboximidamide Openeye Name: N-(azepan-1-ylsulfonyl)-5-(4-chlorophenyl)-N'-methyl-4-phenyl-3,4-dihydropyrazole-2-carboxamidine CAS Name: N-(1-azepanylsulfonyl)-5-(4-chlorophenyl)-N'-methyl-4-phenyl-3,4-dihydropyrazole-2-carboximidamide IUPAC Name: N-(azepan-1-ylsulfonyl)-5-(4-chlorophenyl)-N'-methyl-4-phenyl-3,4-dihydropyrazole-2-carboximidamide Traditional Name: N-(azepan-1-ylsulfonyl)-3-(4-chlorophenyl)-N'-methyl-4-phenyl-2-pyrazoline-1-carboxamidine Formula: C23H28ClN5O2S MolecularWeight: 474.01872

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NS(=O)(=O)N1CCCCCC1)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CN=C(NS(=O)(=O)N1CCCCCC1)N2CC(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H28ClN5O2S/c1-25-23(27-32(30,31)28-15-7-2-3-8-16-28)29-17-21(18-9-5-4-6-10-18)22(26-29)19-11-13-20(24)14-12-19/h4-6,9-14,21H,2-3,7-8,15-17H2,1H3,(H,25,27)