3-[5-[(5-benzamido-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanoic acid

Systemtic Name: 3-[5-[(5-benzamido-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanoic acid Openeye Name: 3-[5-(5-benzamidothiazol-2-yl)sulfanyl-1,3,4-thiadiazol-2-yl]propanoic acid CAS Name: 3-[5-[(5-benzamido-2-thiazolyl)thio]-1,3,4-thiadiazol-2-yl]propanoic acid IUPAC Name: 3-[5-[(5-benzamido-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanoic acid Traditional Name: 3-[5-[(5-benzamidothiazol-2-yl)thio]-1,3,4-thiadiazol-2-yl]propionic acid Formula: C15H12N4O3S3 MolecularWeight: 392.47578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CN=C(S2)SC3=NN=C(S3)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CN=C(S2)SC3=NN=C(S3)CCC(=O)O

InChI

InChI=1S/C15H12N4O3S3/c20-12(21)7-6-10-18-19-15(23-10)25-14-16-8-11(24-14)17-13(22)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,17,22)(H,20,21)