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

Systemtic Name: 3-azanyl-N-(3-chloranyl-2-methyl-phenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide Openeye Name: 3-amino-N-(3-chloro-2-methyl-phenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide CAS Name: 3-amino-N-(3-chloro-2-methylphenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide IUPAC Name: 3-amino-N-(3-chloro-2-methylphenyl)-4-(1,4-diazepan-1-yl)benzenesulfonamide Traditional Name: 3-amino-N-(3-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=CC=C1Cl)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCNCC3)N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCNCC3)N

InChI

InChI=1S/C18H23ClN4O2S/c1-13-15(19)4-2-5-17(13)22-26(24,25)14-6-7-18(16(20)12-14)23-10-3-8-21-9-11-23/h2,4-7,12,21-22H,3,8-11,20H2,1H3