(2R)-2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: (2R)-2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: (2R)-2-[2-(1-adamantylamino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: (2R)-2-[[2-(1-adamantylamino)-2-oxoethyl]thio]propanoate IUPAC Name: (2R)-2-[2-(1-adamantylamino)-2-oxoethyl]sulfanylpropanoate Traditional Name: (2R)-2-[[2-(1-adamantylamino)-2-keto-ethyl]thio]propionate Formula: C15H22NO3S- MolecularWeight: 296.40508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SCC(=O)NC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

C[C@H](C(=O)[O-])SCC(=O)NC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C15H23NO3S/c1-9(14(18)19)20-8-13(17)16-15-5-10-2-11(6-15)4-12(3-10)7-15/h9-12H,2-8H2,1H3,(H,16,17)(H,18,19)/p-1/t9-,10?,11?,12?,15?/m1/s1