(2S)-2-(3-methylcyclohexyl)-N-(2-oxidanylsulfonothioyloxyethyl)butan-1-amine

Systemtic Name: (2S)-2-(3-methylcyclohexyl)-N-(2-oxidanylsulfonothioyloxyethyl)butan-1-amine Openeye Name: (2S)-N-(2-hydroxysulfonothioyloxyethyl)-2-(3-methylcyclohexyl)butan-1-amine CAS Name: (2S)-N-(2-hydroxysulfonothioyloxyethyl)-2-(3-methylcyclohexyl)-1-butanamine IUPAC Name: (2S)-N-(2-hydroxysulfonothioyloxyethyl)-2-(3-methylcyclohexyl)butan-1-amine Traditional Name: 2-hydroxysulfonothioyloxyethyl-[(2S)-2-(3-methylcyclohexyl)butyl]amine Formula: C13H27NO3S2 MolecularWeight: 309.48838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNCCOS(=O)(=S)O)C1CCCC(C1)C

Isomeric SMILES

CC[C@H](CNCCOS(=O)(=S)O)C1CCCC(C1)C

InChI

InChI=1S/C13H27NO3S2/c1-3-12(13-6-4-5-11(2)9-13)10-14-7-8-17-19(15,16)18/h11-14H,3-10H2,1-2H3,(H,15,16,18)/t11?,12-,13?/m1/s1