2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-1-(2-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-1-(2-methylpiperidin-1-yl)ethanone Openeye Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(2-methyl-1-piperidyl)ethanone CAS Name: 2-[4-(1-azepanylsulfonyl)anilino]-1-(2-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(2-methylpiperidin-1-yl)ethanone Traditional Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(2-methylpiperidino)ethanone Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1CCCCN1C(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H31N3O3S/c1-17-8-4-7-15-23(17)20(24)16-21-18-9-11-19(12-10-18)27(25,26)22-13-5-2-3-6-14-22/h9-12,17,21H,2-8,13-16H2,1H3