ethyl (2E)-3-azanyl-2-[5-(4-chlorophenyl)-3H-1,3,4-oxadiazol-2-ylidene]-3-sulfanylidene-propanoate

Systemtic Name: ethyl (2E)-3-azanyl-2-[5-(4-chlorophenyl)-3H-1,3,4-oxadiazol-2-ylidene]-3-sulfanylidene-propanoate Openeye Name: ethyl (2E)-3-amino-2-[5-(4-chlorophenyl)-3H-1,3,4-oxadiazol-2-ylidene]-3-thioxo-propanoate CAS Name: (2E)-3-amino-2-[5-(4-chlorophenyl)-3H-1,3,4-oxadiazol-2-ylidene]-3-sulfanylidenepropanoic acid ethyl ester IUPAC Name: ethyl (2E)-3-amino-2-[5-(4-chlorophenyl)-3H-1,3,4-oxadiazol-2-ylidene]-3-sulfanylidenepropanoate Traditional Name: (2E)-3-amino-2-[5-(4-chlorophenyl)-3H-1,3,4-oxadiazol-2-ylidene]-3-thioxo-propionic acid ethyl ester Formula: C13H12ClN3O3S MolecularWeight: 325.77068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12ClN3O3S/c1-2-19-13(18)9(10(15)21)12-17-16-11(20-12)7-3-5-8(14)6-4-7/h3-6,17H,2H2,1H3,(H2,15,21)/b12-9-