azepan-1-yl-[1-(4-methylsulfonylphenyl)carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(4-methylsulfonylphenyl)carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(4-methylsulfonylbenzoyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[(4-methylsulfonylphenyl)-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(4-methylsulfonylbenzoyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(4-mesylbenzoyl)-4-piperidyl]methanone Formula: C20H28N2O4S MolecularWeight: 392.51232

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C20H28N2O4S/c1-27(25,26)18-8-6-16(7-9-18)19(23)22-14-10-17(11-15-22)20(24)21-12-4-2-3-5-13-21/h6-9,17H,2-5,10-15H2,1H3