ethyl 2-[[5-(pyridin-4-ylcarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-(pyridin-4-ylcarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-(pyridine-4-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[oxo(pyridin-4-yl)methyl]amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(pyridine-4-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[(5-isonicotinamido-1,3,4-thiadiazol-2-yl)thio]acetic acid ethyl ester Formula: C12H12N4O3S2 MolecularWeight: 324.37868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=CC=NC=C2

InChI

InChI=1S/C12H12N4O3S2/c1-2-19-9(17)7-20-12-16-15-11(21-12)14-10(18)8-3-5-13-6-4-8/h3-6H,2,7H2,1H3,(H,14,15,18)