2-[(3-bromophenyl)-(phenylsulfonyl)amino]-N-cycloheptyl-ethanamide

Systemtic Name: 2-[(3-bromophenyl)-(phenylsulfonyl)amino]-N-cycloheptyl-ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-bromo-anilino]-N-cycloheptyl-acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-bromoanilino]-N-cycloheptylacetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-bromoanilino]-N-cycloheptylacetamide Traditional Name: 2-(N-besyl-3-bromo-anilino)-N-cycloheptyl-acetamide Formula: C21H25BrN2O3S MolecularWeight: 465.4038

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CN(C2=CC(=CC=C2)Br)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCCC(CC1)NC(=O)CN(C2=CC(=CC=C2)Br)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25BrN2O3S/c22-17-9-8-12-19(15-17)24(28(26,27)20-13-6-3-7-14-20)16-21(25)23-18-10-4-1-2-5-11-18/h3,6-9,12-15,18H,1-2,4-5,10-11,16H2,(H,23,25)