(2S,3S)-2-[(5-bromanylthiophen-2-yl)carbonylamino]-3-methyl-pentanoic acid

Systemtic Name: (2S,3S)-2-[(5-bromanylthiophen-2-yl)carbonylamino]-3-methyl-pentanoic acid Openeye Name: (2S,3S)-2-[(5-bromothiophene-2-carbonyl)amino]-3-methyl-pentanoic acid CAS Name: (2S,3S)-2-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: (2S,3S)-2-[(5-bromothiophene-2-carbonyl)amino]-3-methylpentanoic acid Traditional Name: (2S,3S)-2-[(5-bromothiophene-2-carbonyl)amino]-3-methyl-valeric acid Formula: C11H14BrNO3S MolecularWeight: 320.20276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C1=CC=C(S1)Br

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)NC(=O)C1=CC=C(S1)Br

InChI

InChI=1S/C11H14BrNO3S/c1-3-6(2)9(11(15)16)13-10(14)7-4-5-8(12)17-7/h4-6,9H,3H2,1-2H3,(H,13,14)(H,15,16)/t6-,9-/m0/s1