4-bromanyl-N-[2-(oxan-4-yl)ethyl]-1-(phenylsulfonyl)indole-3-sulfonamide

Systemtic Name: 4-bromanyl-N-[2-(oxan-4-yl)ethyl]-1-(phenylsulfonyl)indole-3-sulfonamide Openeye Name: 1-(benzenesulfonyl)-4-bromo-N-(2-tetrahydropyran-4-ylethyl)indole-3-sulfonamide CAS Name: 1-(benzenesulfonyl)-4-bromo-N-[2-(4-oxanyl)ethyl]-3-indolesulfonamide IUPAC Name: 1-(benzenesulfonyl)-4-bromo-N-[2-(oxan-4-yl)ethyl]indole-3-sulfonamide Traditional Name: 1-besyl-4-bromo-N-(2-tetrahydropyran-4-ylethyl)indole-3-sulfonamide Formula: C21H23BrN2O5S2 MolecularWeight: 527.45172

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CCNS(=O)(=O)C2=CN(C3=C2C(=CC=C3)Br)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1COCCC1CCNS(=O)(=O)C2=CN(C3=C2C(=CC=C3)Br)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H23BrN2O5S2/c22-18-7-4-8-19-21(18)20(15-24(19)31(27,28)17-5-2-1-3-6-17)30(25,26)23-12-9-16-10-13-29-14-11-16/h1-8,15-16,23H,9-14H2