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2-[2-adamantyl-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid

2-[2-adamantyl-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid

Systemtic Name:2-[2-adamantyl-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid
Openeye Name:2-[2-adamantyl-(2-methyl-3-sulfanyl-propanoyl)amino]acetic acid
CAS Name:2-[2-adamantyl-(3-mercapto-2-methyl-1-oxopropyl)amino]acetic acid
IUPAC Name:2-[2-adamantyl-(2-methyl-3-sulfanylpropanoyl)amino]acetic acid
Traditional Name:2-[2-adamantyl-(3-mercapto-2-methyl-propanoyl)amino]acetic acid
Formula: C16H25NO3S
MolecularWeight: 311.4396
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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N(CC(=O)O)C1C2CC3CC(C2)CC1C3


Isomeric SMILES

CC(CS)C(=O)N(CC(=O)O)C1C2CC3CC(C2)CC1C3


InChI

InChI=1S/C16H25NO3S/c1-9(8-21)16(20)17(7-14(18)19)15-12-3-10-2-11(5-12)6-13(15)4-10/h9-13,15,21H,2-8H2,1H3,(H,18,19)


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