2-(cyclooctylamino)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(cyclooctylamino)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(cyclooctylamino)ethanone CAS Name: 2-(cyclooctylamino)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(cyclooctylamino)ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(cyclooctylamino)ethanone Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CCCC(CCC1)NCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H33N3O3S/c25-21(17-22-20-11-7-2-1-3-8-12-20)23-13-15-24(16-14-23)28(26,27)18-19-9-5-4-6-10-19/h4-6,9-10,20,22H,1-3,7-8,11-18H2