azepan-1-yl-[1-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[4-methyl-3-(1-piperidylsulfonyl)benzoyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(4-methyl-3-piperidin-1-ylsulfonylbenzoyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(4-methyl-3-piperidinosulfonyl-benzoyl)-4-piperidyl]methanone Formula: C25H37N3O4S MolecularWeight: 475.64398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H37N3O4S/c1-20-9-10-22(19-23(20)33(31,32)28-15-7-4-8-16-28)25(30)27-17-11-21(12-18-27)24(29)26-13-5-2-3-6-14-26/h9-10,19,21H,2-8,11-18H2,1H3