N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-oxidanylidene-1,3-dihydroindole-5-sulfonamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-oxidanylidene-1,3-dihydroindole-5-sulfonamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-oxo-indoline-5-sulfonamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-keto-indoline-5-sulfonamide Formula: C21H25N3O6S2 MolecularWeight: 479.5697

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)C4

InChI

InChI=1S/C21H25N3O6S2/c1-30-20-9-7-17(32(28,29)24-10-4-2-3-5-11-24)14-19(20)23-31(26,27)16-6-8-18-15(12-16)13-21(25)22-18/h6-9,12,14,23H,2-5,10-11,13H2,1H3,(H,22,25)