methyl 2-[2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: methyl 2-[2-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: methyl 2-[2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]amino]-4-thiazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(4-bromo-1-methylpyrrole-2-carbonyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]thiazol-4-yl]acetic acid methyl ester Formula: C12H12BrN3O3S MolecularWeight: 358.21098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=NC(=CS2)CC(=O)OC)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=NC(=CS2)CC(=O)OC)Br

InChI

InChI=1S/C12H12BrN3O3S/c1-16-5-7(13)3-9(16)11(18)15-12-14-8(6-20-12)4-10(17)19-2/h3,5-6H,4H2,1-2H3,(H,14,15,18)