3-azanyl-N-(5-chloranyl-2-methyl-phenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide

Systemtic Name: 3-azanyl-N-(5-chloranyl-2-methyl-phenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide Openeye Name: 3-amino-N-(5-chloro-2-methyl-phenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide CAS Name: 3-amino-N-(5-chloro-2-methylphenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide IUPAC Name: 3-amino-N-(5-chloro-2-methylphenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide Traditional Name: 3-amino-N-(5-chloro-2-methyl-phenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide Formula: C18H23ClN4O2S MolecularWeight: 394.91882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCNCC3)N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCNCC3)N

InChI

InChI=1S/C18H23ClN4O2S/c1-13-3-4-14(19)11-17(13)22-26(24,25)15-5-6-18(16(20)12-15)23-9-2-7-21-8-10-23/h3-6,11-12,21-22H,2,7-10,20H2,1H3