(2R)-2-(6-azanylhexanoylamino)-3-(phenylmethylsulfanyl)propanoic acid

Systemtic Name: (2R)-2-(6-azanylhexanoylamino)-3-(phenylmethylsulfanyl)propanoic acid Openeye Name: (2R)-2-(6-aminohexanoylamino)-3-benzylsulfanyl-propanoic acid CAS Name: (2R)-2-[(6-amino-1-oxohexyl)amino]-3-(phenylmethylthio)propanoic acid IUPAC Name: (2R)-2-(6-aminohexanoylamino)-3-benzylsulfanylpropanoic acid Traditional Name: (2R)-2-(6-aminohexanoylamino)-3-(benzylthio)propionic acid Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(C(=O)O)NC(=O)CCCCCN

Isomeric SMILES

C1=CC=C(C=C1)CSC[C@@H](C(=O)O)NC(=O)CCCCCN

InChI

InChI=1S/C16H24N2O3S/c17-10-6-2-5-9-15(19)18-14(16(20)21)12-22-11-13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12,17H2,(H,18,19)(H,20,21)/t14-/m0/s1