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

Systemtic Name: 4-methyl-1-(phenylsulfonyl)-N-(2-pyridin-3-ylethyl)indole-3-sulfonamide Openeye Name: 1-(benzenesulfonyl)-4-methyl-N-[2-(3-pyridyl)ethyl]indole-3-sulfonamide CAS Name: 1-(benzenesulfonyl)-4-methyl-N-[2-(3-pyridinyl)ethyl]-3-indolesulfonamide IUPAC Name: 1-(benzenesulfonyl)-4-methyl-N-(2-pyridin-3-ylethyl)indole-3-sulfonamide Traditional Name: 1-besyl-4-methyl-N-[2-(3-pyridyl)ethyl]indole-3-sulfonamide Formula: C22H21N3O4S2 MolecularWeight: 455.54984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(C=C2S(=O)(=O)NCCC3=CN=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC=C1)N(C=C2S(=O)(=O)NCCC3=CN=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O4S2/c1-17-7-5-11-20-22(17)21(16-25(20)31(28,29)19-9-3-2-4-10-19)30(26,27)24-14-12-18-8-6-13-23-15-18/h2-11,13,15-16,24H,12,14H2,1H3