(2S)-2-[(5-bromanylthiophen-2-yl)methylcarbamoylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[(5-bromanylthiophen-2-yl)methylcarbamoylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[(5-bromo-2-thienyl)methylcarbamoylamino]-3-methyl-butanoate CAS Name: (2S)-2-[[[(5-bromo-2-thiophenyl)methylamino]-oxomethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[(5-bromothiophen-2-yl)methylcarbamoylamino]-3-methylbutanoate Traditional Name: (2S)-2-[(5-bromo-2-thienyl)methylcarbamoylamino]-3-methyl-butyrate Formula: C11H14BrN2O3S- MolecularWeight: 334.20946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)NCC1=CC=C(S1)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)NCC1=CC=C(S1)Br

InChI

InChI=1S/C11H15BrN2O3S/c1-6(2)9(10(15)16)14-11(17)13-5-7-3-4-8(12)18-7/h3-4,6,9H,5H2,1-2H3,(H,15,16)(H2,13,14,17)/p-1/t9-/m0/s1