4-bromanyl-N-[1-(4-cyanophenyl)carbonylpiperidin-4-yl]-1-(phenylsulfonyl)indole-3-sulfonamide

Systemtic Name: 4-bromanyl-N-[1-(4-cyanophenyl)carbonylpiperidin-4-yl]-1-(phenylsulfonyl)indole-3-sulfonamide Openeye Name: 1-(benzenesulfonyl)-4-bromo-N-[1-(4-cyanobenzoyl)-4-piperidyl]indole-3-sulfonamide CAS Name: 1-(benzenesulfonyl)-4-bromo-N-[1-[(4-cyanophenyl)-oxomethyl]-4-piperidinyl]-3-indolesulfonamide IUPAC Name: 1-(benzenesulfonyl)-4-bromo-N-[1-(4-cyanobenzoyl)piperidin-4-yl]indole-3-sulfonamide Traditional Name: 1-besyl-4-bromo-N-[1-(4-cyanobenzoyl)-4-piperidyl]indole-3-sulfonamide Formula: C27H23BrN4O5S2 MolecularWeight: 627.52932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=CN(C3=C2C(=CC=C3)Br)S(=O)(=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=CN(C3=C2C(=CC=C3)Br)S(=O)(=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H23BrN4O5S2/c28-23-7-4-8-24-26(23)25(18-32(24)39(36,37)22-5-2-1-3-6-22)38(34,35)30-21-13-15-31(16-14-21)27(33)20-11-9-19(17-29)10-12-20/h1-12,18,21,30H,13-16H2