(2S)-3-phenyl-2-[[1-(sulfanylmethyl)cyclopentyl]carbonylamino]propanoic acid

Systemtic Name: (2S)-3-phenyl-2-[[1-(sulfanylmethyl)cyclopentyl]carbonylamino]propanoic acid Openeye Name: (2S)-3-phenyl-2-[[1-(sulfanylmethyl)cyclopentanecarbonyl]amino]propanoic acid CAS Name: (2S)-2-[[[1-(mercaptomethyl)cyclopentyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-3-phenyl-2-[[1-(sulfanylmethyl)cyclopentanecarbonyl]amino]propanoic acid Traditional Name: (2S)-2-[[1-(mercaptomethyl)cyclopentanecarbonyl]amino]-3-phenyl-propionic acid Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CS)C(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CCC(C1)(CS)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H21NO3S/c18-14(19)13(10-12-6-2-1-3-7-12)17-15(20)16(11-21)8-4-5-9-16/h1-3,6-7,13,21H,4-5,8-11H2,(H,17,20)(H,18,19)/t13-/m0/s1