ethyl (2Z)-3-azanyl-2-(5-pyridin-4-yl-3H-1,3,4-oxadiazol-2-ylidene)-3-sulfanylidene-propanoate

Systemtic Name: ethyl (2Z)-3-azanyl-2-(5-pyridin-4-yl-3H-1,3,4-oxadiazol-2-ylidene)-3-sulfanylidene-propanoate Openeye Name: ethyl (2Z)-3-amino-2-[5-(4-pyridyl)-3H-1,3,4-oxadiazol-2-ylidene]-3-thioxo-propanoate CAS Name: (2Z)-3-amino-2-(5-pyridin-4-yl-3H-1,3,4-oxadiazol-2-ylidene)-3-sulfanylidenepropanoic acid ethyl ester IUPAC Name: ethyl (2Z)-3-amino-2-(5-pyridin-4-yl-3H-1,3,4-oxadiazol-2-ylidene)-3-sulfanylidenepropanoate Traditional Name: (2Z)-3-amino-2-[5-(4-pyridyl)-3H-1,3,4-oxadiazol-2-ylidene]-3-thioxo-propionic acid ethyl ester Formula: C12H12N4O3S MolecularWeight: 292.31368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1NN=C(O1)C2=CC=NC=C2)C(=S)N

Isomeric SMILES

CCOC(=O)/C(=C/1\NN=C(O1)C2=CC=NC=C2)/C(=S)N

InChI

InChI=1S/C12H12N4O3S/c1-2-18-12(17)8(9(13)20)11-16-15-10(19-11)7-3-5-14-6-4-7/h3-6,16H,2H2,1H3,(H2,13,20)/b11-8+