methyl (2S)-2-(2-cyclopentylsulfanylethanoylamino)-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-(2-cyclopentylsulfanylethanoylamino)-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(2-cyclopentylsulfanylacetyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-(cyclopentylthio)-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-cyclopentylsulfanylacetyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-(cyclopentylthio)acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C17H23NO3S MolecularWeight: 321.43442

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CSC2CCCC2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CSC2CCCC2

InChI

InChI=1S/C17H23NO3S/c1-21-17(20)15(11-13-7-3-2-4-8-13)18-16(19)12-22-14-9-5-6-10-14/h2-4,7-8,14-15H,5-6,9-12H2,1H3,(H,18,19)/t15-/m0/s1