4-[(1S)-3-methylcyclohexyl]-N-(2-oxidanylsulfonothioyloxyethyl)butan-1-amine

Systemtic Name: 4-[(1S)-3-methylcyclohexyl]-N-(2-oxidanylsulfonothioyloxyethyl)butan-1-amine Openeye Name: N-(2-hydroxysulfonothioyloxyethyl)-4-[(1S)-3-methylcyclohexyl]butan-1-amine CAS Name: N-(2-hydroxysulfonothioyloxyethyl)-4-[(1S)-3-methylcyclohexyl]-1-butanamine IUPAC Name: N-(2-hydroxysulfonothioyloxyethyl)-4-[(1S)-3-methylcyclohexyl]butan-1-amine Traditional Name: 2-hydroxysulfonothioyloxyethyl-[4-[(1S)-3-methylcyclohexyl]butyl]amine Formula: C13H27NO3S2 MolecularWeight: 309.48838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)CCCCNCCOS(=O)(=S)O

Isomeric SMILES

CC1CCC[C@H](C1)CCCCNCCOS(=O)(=S)O

InChI

InChI=1S/C13H27NO3S2/c1-12-5-4-7-13(11-12)6-2-3-8-14-9-10-17-19(15,16)18/h12-14H,2-11H2,1H3,(H,15,16,18)/t12?,13-/m1/s1