2-(1-adamantylcarbamoylamino)-3-methylsulfanyl-propanoic acid

Systemtic Name: 2-(1-adamantylcarbamoylamino)-3-methylsulfanyl-propanoic acid Openeye Name: 2-(1-adamantylcarbamoylamino)-3-methylsulfanyl-propanoic acid CAS Name: 2-[[(1-adamantylamino)-oxomethyl]amino]-3-(methylthio)propanoic acid IUPAC Name: 2-(1-adamantylcarbamoylamino)-3-methylsulfanylpropanoic acid Traditional Name: 2-(1-adamantylcarbamoylamino)-3-(methylthio)propionic acid Formula: C15H24N2O3S MolecularWeight: 312.42766

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)O)NC(=O)NC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CSCC(C(=O)O)NC(=O)NC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C15H24N2O3S/c1-21-8-12(13(18)19)16-14(20)17-15-5-9-2-10(6-15)4-11(3-9)7-15/h9-12H,2-8H2,1H3,(H,18,19)(H2,16,17,20)