(2R)-2-[[2-azanyl-3,5-bis(bromanyl)phenyl]methylamino]-3-methylsulfanyl-propanoic acid

Systemtic Name: (2R)-2-[[2-azanyl-3,5-bis(bromanyl)phenyl]methylamino]-3-methylsulfanyl-propanoic acid Openeye Name: (2R)-2-[(2-amino-3,5-dibromo-phenyl)methylamino]-3-methylsulfanyl-propanoic acid CAS Name: (2R)-2-[(2-amino-3,5-dibromophenyl)methylamino]-3-(methylthio)propanoic acid IUPAC Name: (2R)-2-[(2-amino-3,5-dibromophenyl)methylamino]-3-methylsulfanylpropanoic acid Traditional Name: (2R)-2-[(2-amino-3,5-dibromo-benzyl)amino]-3-(methylthio)propionic acid Formula: C11H14Br2N2O2S MolecularWeight: 398.11406

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)O)NCC1=CC(=CC(=C1N)Br)Br

Isomeric SMILES

CSC[C@@H](C(=O)O)NCC1=CC(=CC(=C1N)Br)Br

InChI

InChI=1S/C11H14Br2N2O2S/c1-18-5-9(11(16)17)15-4-6-2-7(12)3-8(13)10(6)14/h2-3,9,15H,4-5,14H2,1H3,(H,16,17)/t9-/m0/s1