2-[cyclopentylcarbonyl(2-methylsulfanylethyl)amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[cyclopentylcarbonyl(2-methylsulfanylethyl)amino]-3-phenyl-propanoic acid Openeye Name: 2-[cyclopentanecarbonyl(2-methylsulfanylethyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[[cyclopentyl(oxo)methyl]-[2-(methylthio)ethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[cyclopentanecarbonyl(2-methylsulfanylethyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[cyclopentanecarbonyl-[2-(methylthio)ethyl]amino]-3-phenyl-propionic acid Formula: C18H25NO3S MolecularWeight: 335.461

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Descriptors Computed from Structure

Canonical SMILES:

CSCCN(C(CC1=CC=CC=C1)C(=O)O)C(=O)C2CCCC2

Isomeric SMILES

CSCCN(C(CC1=CC=CC=C1)C(=O)O)C(=O)C2CCCC2

InChI

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