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

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Openeye Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone CAS Name: 2-[4-(1-azepanylsulfonyl)anilino]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Traditional Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C23H29N3O3S/c27-23(26-17-7-9-19-8-3-4-10-22(19)26)18-24-20-11-13-21(14-12-20)30(28,29)25-15-5-1-2-6-16-25/h3-4,8,10-14,24H,1-2,5-7,9,15-18H2