4-(2-sulfosulfanylethylamino)butylcycloheptane

Systemtic Name: 4-(2-sulfosulfanylethylamino)butylcycloheptane Openeye Name: 4-(2-sulfosulfanylethylamino)butylcycloheptane CAS Name: 4-[2-(sulfothio)ethylamino]butylcycloheptane IUPAC Name: 4-(2-sulfosulfanylethylamino)butylcycloheptane Traditional Name: 4-[2-(sulfothio)ethylamino]butylcycloheptane Formula: C13H27NO3S2 MolecularWeight: 309.48838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)CCCCNCCSS(=O)(=O)O

Isomeric SMILES

C1CCCC(CC1)CCCCNCCSS(=O)(=O)O

InChI

InChI=1S/C13H27NO3S2/c15-19(16,17)18-12-11-14-10-6-5-9-13-7-3-1-2-4-8-13/h13-14H,1-12H2,(H,15,16,17)