(2S)-4-azanyl-2-[(5-bromanylthiophen-2-yl)carbonylamino]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-azanyl-2-[(5-bromanylthiophen-2-yl)carbonylamino]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-amino-2-[(5-bromothiophene-2-carbonyl)amino]-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-4-oxobutanoate IUPAC Name: (2S)-4-amino-2-[(5-bromothiophene-2-carbonyl)amino]-4-oxobutanoate Traditional Name: (2S)-4-amino-2-[(5-bromothiophene-2-carbonyl)amino]-4-keto-butyrate Formula: C9H8BrN2O4S- MolecularWeight: 320.13982

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)C(=O)NC(CC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=C(SC(=C1)Br)C(=O)N[C@@H](CC(=O)N)C(=O)[O-]

InChI

InChI=1S/C9H9BrN2O4S/c10-6-2-1-5(17-6)8(14)12-4(9(15)16)3-7(11)13/h1-2,4H,3H2,(H2,11,13)(H,12,14)(H,15,16)/p-1/t4-/m0/s1