4-bromanyl-1-(phenylsulfonyl)-N-(2-pyridin-3-ylethyl)indole-3-sulfonamide

Systemtic Name: 4-bromanyl-1-(phenylsulfonyl)-N-(2-pyridin-3-ylethyl)indole-3-sulfonamide Openeye Name: 1-(benzenesulfonyl)-4-bromo-N-[2-(3-pyridyl)ethyl]indole-3-sulfonamide CAS Name: 1-(benzenesulfonyl)-4-bromo-N-[2-(3-pyridinyl)ethyl]-3-indolesulfonamide IUPAC Name: 1-(benzenesulfonyl)-4-bromo-N-(2-pyridin-3-ylethyl)indole-3-sulfonamide Traditional Name: 1-besyl-4-bromo-N-[2-(3-pyridyl)ethyl]indole-3-sulfonamide Formula: C21H18BrN3O4S2 MolecularWeight: 520.41932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC=C3Br)S(=O)(=O)NCCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC=C3Br)S(=O)(=O)NCCC4=CN=CC=C4

InChI

InChI=1S/C21H18BrN3O4S2/c22-18-9-4-10-19-21(18)20(15-25(19)31(28,29)17-7-2-1-3-8-17)30(26,27)24-13-11-16-6-5-12-23-14-16/h1-10,12,14-15,24H,11,13H2