ethyl 2-[[5-[(6-phenoxypyridin-3-yl)carbonylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-[(6-phenoxypyridin-3-yl)carbonylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-[(6-phenoxypyridine-3-carbonyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[oxo-(6-phenoxy-3-pyridinyl)methyl]amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-[(6-phenoxypyridine-3-carbonyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[(6-phenoxynicotinoyl)amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester Formula: C18H16N4O4S2 MolecularWeight: 416.47404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=CN=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=CN=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H16N4O4S2/c1-2-25-15(23)11-27-18-22-21-17(28-18)20-16(24)12-8-9-14(19-10-12)26-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,20,21,24)