5-chloranyl-N-[(2S,3R)-3-(2-methylpropyl)-1-oxidanyl-octan-2-yl]thiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-N-[(2S,3R)-3-(2-methylpropyl)-1-oxidanyl-octan-2-yl]thiophene-2-sulfonamide Openeye Name: 5-chloro-N-[(1S,2R)-1-(hydroxymethyl)-2-isobutyl-heptyl]thiophene-2-sulfonamide CAS Name: 5-chloro-N-[(2S,3R)-1-hydroxy-3-(2-methylpropyl)octan-2-yl]-2-thiophenesulfonamide IUPAC Name: 5-chloro-N-[(2S,3R)-1-hydroxy-3-(2-methylpropyl)octan-2-yl]thiophene-2-sulfonamide Traditional Name: 5-chloro-N-[(1S,2R)-2-isobutyl-1-methylol-heptyl]thiophene-2-sulfonamide Formula: C16H28ClNO3S2 MolecularWeight: 381.98142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(C)C)C(CO)NS(=O)(=O)C1=CC=C(S1)Cl

Isomeric SMILES

CCCCC[C@H](CC(C)C)[C@@H](CO)NS(=O)(=O)C1=CC=C(S1)Cl

InChI

InChI=1S/C16H28ClNO3S2/c1-4-5-6-7-13(10-12(2)3)14(11-19)18-23(20,21)16-9-8-15(17)22-16/h8-9,12-14,18-19H,4-7,10-11H2,1-3H3/t13-,14-/m1/s1