2-azanyl-2-[(5-bromanyl-4-methyl-thiophen-2-yl)carbonylamino]pentanedioic acid

Systemtic Name: 2-azanyl-2-[(5-bromanyl-4-methyl-thiophen-2-yl)carbonylamino]pentanedioic acid Openeye Name: 2-amino-2-[(5-bromo-4-methyl-thiophene-2-carbonyl)amino]pentanedioic acid CAS Name: 2-amino-2-[[(5-bromo-4-methyl-2-thiophenyl)-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-amino-2-[(5-bromo-4-methylthiophene-2-carbonyl)amino]pentanedioic acid Traditional Name: 2-amino-2-[(5-bromo-4-methyl-thiophene-2-carbonyl)amino]glutaric acid Formula: C11H13BrN2O5S MolecularWeight: 365.20032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C(=O)NC(CCC(=O)O)(C(=O)O)N)Br

Isomeric SMILES

CC1=C(SC(=C1)C(=O)NC(CCC(=O)O)(C(=O)O)N)Br

InChI

InChI=1S/C11H13BrN2O5S/c1-5-4-6(20-8(5)12)9(17)14-11(13,10(18)19)3-2-7(15)16/h4H,2-3,13H2,1H3,(H,14,17)(H,15,16)(H,18,19)