N-[[(1S,3R)-3-azanylcyclopentyl]methyl]-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-[[(1S,3R)-3-azanylcyclopentyl]methyl]-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-[[(1S,3R)-3-aminocyclopentyl]methyl]-4-methylsulfanyl-benzenesulfonamide CAS Name: N-[[(1S,3R)-3-aminocyclopentyl]methyl]-4-(methylthio)benzenesulfonamide IUPAC Name: N-[[(1S,3R)-3-aminocyclopentyl]methyl]-4-methylsulfanylbenzenesulfonamide Traditional Name: N-[[(1S,3R)-3-aminocyclopentyl]methyl]-4-(methylthio)benzenesulfonamide Formula: C13H20N2O2S2 MolecularWeight: 300.4401

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(C2)N

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)NC[C@H]2CC[C@H](C2)N

InChI

InChI=1S/C13H20N2O2S2/c1-18-12-4-6-13(7-5-12)19(16,17)15-9-10-2-3-11(14)8-10/h4-7,10-11,15H,2-3,8-9,14H2,1H3/t10-,11+/m0/s1