[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 5-[(3R)-1,2-dithiolan-3-yl]pentanoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 5-[(3R)-1,2-dithiolan-3-yl]pentanoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 5-[(3R)-dithiolan-3-yl]pentanoate CAS Name: 5-[(3R)-3-dithiolanyl]pentanoic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 5-[(3R)-dithiolan-3-yl]pentanoate Traditional Name: 5-[(3R)-dithiolan-3-yl]valeric acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C16H24N2O3S2 MolecularWeight: 356.50336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)COC(=O)CCCCC2CCSS2

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)COC(=O)CCCC[C@@H]2CCSS2

InChI

InChI=1S/C16H24N2O3S2/c17-12-16(8-3-4-9-16)18-14(19)11-21-15(20)6-2-1-5-13-7-10-22-23-13/h13H,1-11H2,(H,18,19)/t13-/m1/s1