4-(4-chlorophenyl)sulfonyl-N-[(4-methylphenyl)methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-N-[(4-methylphenyl)methyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-(4-chlorophenyl)sulfonyl-N-(p-tolylmethyl)-1,4-diazepane-1-carboxamide CAS Name: 4-(4-chlorophenyl)sulfonyl-N-[(4-methylphenyl)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-(4-chlorophenyl)sulfonyl-N-[(4-methylphenyl)methyl]-1,4-diazepane-1-carboxamide Traditional Name: 4-(4-chlorophenyl)sulfonyl-N-(4-methylbenzyl)-1,4-diazepane-1-carboxamide Formula: C20H24ClN3O3S MolecularWeight: 421.94086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN3O3S/c1-16-3-5-17(6-4-16)15-22-20(25)23-11-2-12-24(14-13-23)28(26,27)19-9-7-18(21)8-10-19/h3-10H,2,11-15H2,1H3,(H,22,25)