4-[(2S)-2-ethylpiperidin-1-yl]sulfonyl-N-[(1R,2S)-2-methylcyclohexyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-[(2S)-2-ethylpiperidin-1-yl]sulfonyl-N-[(1R,2S)-2-methylcyclohexyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-[[(2S)-2-ethyl-1-piperidyl]sulfonyl]-N-[(1R,2S)-2-methylcyclohexyl]benzenesulfonamide CAS Name: 4-[[(2S)-2-ethyl-1-piperidinyl]sulfonyl]-N-[(1R,2S)-2-methylcyclohexyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-[(2S)-2-ethylpiperidin-1-yl]sulfonyl-N-[(1R,2S)-2-methylcyclohexyl]benzenesulfonamide Traditional Name: N-benzyl-4-[(2S)-2-ethylpiperidino]sulfonyl-N-[(1R,2S)-2-methylcyclohexyl]benzenesulfonamide Formula: C27H38N2O4S2 MolecularWeight: 518.73162

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)C4CCCCC4C

Isomeric SMILES

CC[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)[C@@H]4CCCC[C@@H]4C

InChI

InChI=1S/C27H38N2O4S2/c1-3-24-14-9-10-20-28(24)34(30,31)25-16-18-26(19-17-25)35(32,33)29(21-23-12-5-4-6-13-23)27-15-8-7-11-22(27)2/h4-6,12-13,16-19,22,24,27H,3,7-11,14-15,20-21H2,1-2H3/t22-,24-,27+/m0/s1