2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-1-(2,3-dihydroindol-1-yl)ethanone

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-1-(2,3-dihydroindol-1-yl)ethanone Openeye Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-indolin-1-yl-ethanone CAS Name: 2-[4-(1-azepanylsulfonyl)anilino]-1-(2,3-dihydroindol-1-yl)ethanone IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-indolin-1-yl-ethanone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C22H27N3O3S/c26-22(25-16-13-18-7-3-4-8-21(18)25)17-23-19-9-11-20(12-10-19)29(27,28)24-14-5-1-2-6-15-24/h3-4,7-12,23H,1-2,5-6,13-17H2