methyl 3-[5-[4-(4-cyanophenyl)phenyl]-1,3,4-thiadiazol-2-yl]propanoate

Systemtic Name: methyl 3-[5-[4-(4-cyanophenyl)phenyl]-1,3,4-thiadiazol-2-yl]propanoate Openeye Name: methyl 3-[5-[4-(4-cyanophenyl)phenyl]-1,3,4-thiadiazol-2-yl]propanoate CAS Name: 3-[5-[4-(4-cyanophenyl)phenyl]-1,3,4-thiadiazol-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[4-(4-cyanophenyl)phenyl]-1,3,4-thiadiazol-2-yl]propanoate Traditional Name: 3-[5-[4-(4-cyanophenyl)phenyl]-1,3,4-thiadiazol-2-yl]propionic acid methyl ester Formula: C19H15N3O2S MolecularWeight: 349.4063

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=NN=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)CCC1=NN=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H15N3O2S/c1-24-18(23)11-10-17-21-22-19(25-17)16-8-6-15(7-9-16)14-4-2-13(12-20)3-5-14/h2-9H,10-11H2,1H3