azepan-1-yl-[1-[2,4-bis(methylsulfonyl)phenyl]piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[2,4-bis(methylsulfonyl)phenyl]piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[2,4-bis(methylsulfonyl)phenyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[2,4-bis(methylsulfonyl)phenyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[2,4-bis(methylsulfonyl)phenyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(2,4-dimesylphenyl)-4-piperidyl]methanone Formula: C20H30N2O5S2 MolecularWeight: 442.5926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O5S2/c1-28(24,25)17-7-8-18(19(15-17)29(2,26)27)21-13-9-16(10-14-21)20(23)22-11-5-3-4-6-12-22/h7-8,15-16H,3-6,9-14H2,1-2H3