2-[(4-bromophenyl)-(phenylsulfonyl)amino]-N-cycloheptyl-ethanamide

Systemtic Name: 2-[(4-bromophenyl)-(phenylsulfonyl)amino]-N-cycloheptyl-ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-bromo-anilino]-N-cycloheptyl-acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-bromoanilino]-N-cycloheptylacetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-bromoanilino]-N-cycloheptylacetamide Traditional Name: 2-(N-besyl-4-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=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

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