(2R,3R,4S)-N-butyl-5-cyclohexyl-4-(4-methylpentylamino)-2,3-bis(oxidanyl)pentane-1-sulfonamide

Systemtic Name: (2R,3R,4S)-N-butyl-5-cyclohexyl-4-(4-methylpentylamino)-2,3-bis(oxidanyl)pentane-1-sulfonamide Openeye Name: (2R,3R,4S)-N-butyl-5-cyclohexyl-2,3-dihydroxy-4-(isohexylamino)pentane-1-sulfonamide CAS Name: (2R,3R,4S)-N-butyl-5-cyclohexyl-2,3-dihydroxy-4-(4-methylpentylamino)-1-pentanesulfonamide IUPAC Name: (2R,3R,4S)-N-butyl-5-cyclohexyl-2,3-dihydroxy-4-(4-methylpentylamino)pentane-1-sulfonamide Traditional Name: (2R,3R,4S)-N-butyl-5-cyclohexyl-2,3-dihydroxy-4-(isohexylamino)pentane-1-sulfonamide Formula: C21H44N2O4S MolecularWeight: 420.65006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)CC(C(C(CC1CCCCC1)NCCCC(C)C)O)O

Isomeric SMILES

CCCCNS(=O)(=O)C[C@@H]([C@@H]([C@H](CC1CCCCC1)NCCCC(C)C)O)O

InChI

InChI=1S/C21H44N2O4S/c1-4-5-14-23-28(26,27)16-20(24)21(25)19(22-13-9-10-17(2)3)15-18-11-7-6-8-12-18/h17-25H,4-16H2,1-3H3/t19-,20-,21+/m0/s1