N-[3-(azepan-1-ylcarbonyl)-2-methyl-phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-(azepan-1-ylcarbonyl)-2-methyl-phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-(azepane-1-carbonyl)-2-methyl-phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[3-[1-azepanyl(oxo)methyl]-2-methylphenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-(azepane-1-carbonyl)-2-methylphenyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-(azepane-1-carbonyl)-2-methyl-phenyl]-4-methyl-benzenesulfonamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2C)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2C)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H26N2O3S/c1-16-10-12-18(13-11-16)27(25,26)22-20-9-7-8-19(17(20)2)21(24)23-14-5-3-4-6-15-23/h7-13,22H,3-6,14-15H2,1-2H3