2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3-benzothiazole-6-carboxylic acid

Systemtic Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3-benzothiazole-6-carboxylic acid Openeye Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3-benzothiazole-6-carboxylic acid CAS Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]-1,3-benzothiazole-6-carboxylic acid IUPAC Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3-benzothiazole-6-carboxylic acid Traditional Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]-1,3-benzothiazole-6-carboxylic acid Formula: C16H9N3O2S3 MolecularWeight: 371.45656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(S2)SC3=NC4=C(S3)C=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(S2)SC3=NC4=C(S3)C=C(C=C4)C(=O)O

InChI

InChI=1S/C16H9N3O2S3/c20-14(21)10-6-7-11-12(8-10)22-15(17-11)24-16-19-18-13(23-16)9-4-2-1-3-5-9/h1-8H,(H,20,21)