2-[1-[[[(2R)-2-azanyl-3-thiophen-2-yl-propanoyl]amino]methyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[[[(2R)-2-azanyl-3-thiophen-2-yl-propanoyl]amino]methyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[[[(2R)-2-amino-3-(2-thienyl)propanoyl]amino]methyl]cyclohexyl]acetic acid CAS Name: 2-[1-[[[(2R)-2-amino-1-oxo-3-thiophen-2-ylpropyl]amino]methyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[[[(2R)-2-amino-3-thiophen-2-ylpropanoyl]amino]methyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[[[(2R)-2-amino-3-(2-thienyl)propanoyl]amino]methyl]cyclohexyl]acetic acid Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)O)CNC(=O)C(CC2=CC=CS2)N

Isomeric SMILES

C1CCC(CC1)(CC(=O)O)CNC(=O)[C@@H](CC2=CC=CS2)N

InChI

InChI=1S/C16H24N2O3S/c17-13(9-12-5-4-8-22-12)15(21)18-11-16(10-14(19)20)6-2-1-3-7-16/h4-5,8,13H,1-3,6-7,9-11,17H2,(H,18,21)(H,19,20)/t13-/m1/s1