4-[5-[(3-chlorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]butanoic acid

Systemtic Name: 4-[5-[(3-chlorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]butanoic acid Openeye Name: 4-[5-[(3-chlorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]butanoic acid CAS Name: 4-[5-[(3-chloroanilino)-oxomethyl]-1,3,4-thiadiazol-2-yl]butanoic acid IUPAC Name: 4-[5-[(3-chlorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]butanoic acid Traditional Name: 4-[5-[(3-chlorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]butyric acid Formula: C13H12ClN3O3S MolecularWeight: 325.77068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=O)C2=NN=C(S2)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=O)C2=NN=C(S2)CCCC(=O)O

InChI

InChI=1S/C13H12ClN3O3S/c14-8-3-1-4-9(7-8)15-12(20)13-17-16-10(21-13)5-2-6-11(18)19/h1,3-4,7H,2,5-6H2,(H,15,20)(H,18,19)