N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-1-methyl-2-oxidanylidene-3H-indole-5-sulfonamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-1-methyl-2-oxidanylidene-3H-indole-5-sulfonamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-1-methyl-2-oxo-indoline-5-sulfonamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-keto-1-methyl-indoline-5-sulfonamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3)C)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3)C)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H27N3O5S2/c1-16-7-8-18(15-21(16)32(29,30)25-11-5-3-4-6-12-25)23-31(27,28)19-9-10-20-17(13-19)14-22(26)24(20)2/h7-10,13,15,23H,3-6,11-12,14H2,1-2H3