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

Systemtic Name: 2-[(2-methyl-3-sulfanyl-propanoyl)-(2-phenylcyclohexyl)amino]ethanoic acid Openeye Name: 2-[(2-methyl-3-sulfanyl-propanoyl)-(2-phenylcyclohexyl)amino]acetic acid CAS Name: 2-[(3-mercapto-2-methyl-1-oxopropyl)-(2-phenylcyclohexyl)amino]acetic acid IUPAC Name: 2-[(2-methyl-3-sulfanylpropanoyl)-(2-phenylcyclohexyl)amino]acetic acid Traditional Name: 2-[(3-mercapto-2-methyl-propanoyl)-(2-phenylcyclohexyl)amino]acetic acid Formula: C18H25NO3S MolecularWeight: 335.461

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N(CC(=O)O)C1CCCCC1C2=CC=CC=C2

Isomeric SMILES

CC(CS)C(=O)N(CC(=O)O)C1CCCCC1C2=CC=CC=C2

InChI

InChI=1S/C18H25NO3S/c1-13(12-23)18(22)19(11-17(20)21)16-10-6-5-9-15(16)14-7-3-2-4-8-14/h2-4,7-8,13,15-16,23H,5-6,9-12H2,1H3,(H,20,21)