1-(azocan-1-yl)-2-[[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]amino]ethanone

Systemtic Name: 1-(azocan-1-yl)-2-[[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]amino]ethanone Openeye Name: 1-(azocan-1-yl)-2-[2-(dimethylamino)-5-(1-piperidylsulfonyl)anilino]ethanone CAS Name: 1-(1-azocanyl)-2-[2-(dimethylamino)-5-(1-piperidinylsulfonyl)anilino]ethanone IUPAC Name: 1-(azocan-1-yl)-2-[2-(dimethylamino)-5-piperidin-1-ylsulfonylanilino]ethanone Traditional Name: 1-(azocan-1-yl)-2-[2-(dimethylamino)-5-piperidinosulfonyl-anilino]ethanone Formula: C22H36N4O3S MolecularWeight: 436.61124

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC(=O)N3CCCCCCC3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC(=O)N3CCCCCCC3

InChI

InChI=1S/C22H36N4O3S/c1-24(2)21-12-11-19(30(28,29)26-15-9-6-10-16-26)17-20(21)23-18-22(27)25-13-7-4-3-5-8-14-25/h11-12,17,23H,3-10,13-16,18H2,1-2H3