N-[3-(azepan-1-yl)propyl]-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-4-[methyl(p-tolylsulfonyl)amino]benzamide CAS Name: N-[3-(1-azepanyl)propyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-4-[methyl(tosyl)amino]benzamide Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NCCCN3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NCCCN3CCCCCC3

InChI

InChI=1S/C24H33N3O3S/c1-20-8-14-23(15-9-20)31(29,30)26(2)22-12-10-21(11-13-22)24(28)25-16-7-19-27-17-5-3-4-6-18-27/h8-15H,3-7,16-19H2,1-2H3,(H,25,28)