N-[(1R,2S)-2-methylcyclohexyl]-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-[(1R,2S)-2-methylcyclohexyl]-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-[(1R,2S)-2-methylcyclohexyl]-4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzenesulfonamide CAS Name: N-[(1R,2S)-2-methylcyclohexyl]-4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-[(1R,2S)-2-methylcyclohexyl]-4-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N-benzyl-N-[(1R,2S)-2-methylcyclohexyl]-4-[(3S)-3-methylpiperidino]sulfonyl-benzenesulfonamide Formula: C26H36N2O4S2 MolecularWeight: 504.70504

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)C4CCCCC4C

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)[C@@H]4CCCC[C@@H]4C

InChI

InChI=1S/C26H36N2O4S2/c1-21-9-8-18-27(19-21)33(29,30)24-14-16-25(17-15-24)34(31,32)28(20-23-11-4-3-5-12-23)26-13-7-6-10-22(26)2/h3-5,11-12,14-17,21-22,26H,6-10,13,18-20H2,1-2H3/t21-,22-,26+/m0/s1