ethyl 2-[5-[(5-bromanylpyridin-3-yl)carbonylamino]-1,3,4-thiadiazol-2-yl]ethanoate

Systemtic Name: ethyl 2-[5-[(5-bromanylpyridin-3-yl)carbonylamino]-1,3,4-thiadiazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-[(5-bromopyridine-3-carbonyl)amino]-1,3,4-thiadiazol-2-yl]acetate CAS Name: 2-[5-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[(5-bromopyridine-3-carbonyl)amino]-1,3,4-thiadiazol-2-yl]acetate Traditional Name: 2-[5-[(5-bromonicotinoyl)amino]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester Formula: C12H11BrN4O3S MolecularWeight: 371.20974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(S1)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CCOC(=O)CC1=NN=C(S1)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H11BrN4O3S/c1-2-20-10(18)4-9-16-17-12(21-9)15-11(19)7-3-8(13)6-14-5-7/h3,5-6H,2,4H2,1H3,(H,15,17,19)