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

Systemtic Name: methyl 3-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]propanoate Openeye Name: methyl 3-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]propanoate CAS Name: 3-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]propanoate Traditional Name: 3-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]propionic acid methyl ester Formula: C12H11ClN2O2S MolecularWeight: 282.74594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=NN=C(S1)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCC1=NN=C(S1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H11ClN2O2S/c1-17-11(16)7-6-10-14-15-12(18-10)8-2-4-9(13)5-3-8/h2-5H,6-7H2,1H3