(2S)-2-[(5-bromanylthiophen-2-yl)methylcarbamoylamino]-2-cyclopropyl-propanoic acid

Systemtic Name: (2S)-2-[(5-bromanylthiophen-2-yl)methylcarbamoylamino]-2-cyclopropyl-propanoic acid Openeye Name: (2S)-2-[(5-bromo-2-thienyl)methylcarbamoylamino]-2-cyclopropyl-propanoic acid CAS Name: (2S)-2-[[[(5-bromo-2-thiophenyl)methylamino]-oxomethyl]amino]-2-cyclopropylpropanoic acid IUPAC Name: (2S)-2-[(5-bromothiophen-2-yl)methylcarbamoylamino]-2-cyclopropylpropanoic acid Traditional Name: (2S)-2-[(5-bromo-2-thienyl)methylcarbamoylamino]-2-cyclopropyl-propionic acid Formula: C12H15BrN2O3S MolecularWeight: 347.2281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)(C(=O)O)NC(=O)NCC2=CC=C(S2)Br

Isomeric SMILES

C[C@](C1CC1)(C(=O)O)NC(=O)NCC2=CC=C(S2)Br

InChI

InChI=1S/C12H15BrN2O3S/c1-12(10(16)17,7-2-3-7)15-11(18)14-6-8-4-5-9(13)19-8/h4-5,7H,2-3,6H2,1H3,(H,16,17)(H2,14,15,18)/t12-/m0/s1