5-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: 5-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thiophene-2-carboxylate Openeye Name: 5-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-thiophenecarboxylate IUPAC Name: 5-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-thenoate Formula: C14H10N3O2S3- MolecularWeight: 348.4431

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC=C(S3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC=C(S3)C(=O)[O-]

InChI

InChI=1S/C14H11N3O2S3/c18-12(19)11-7-6-10(21-11)8-20-14-17-16-13(22-14)15-9-4-2-1-3-5-9/h1-7H,8H2,(H,15,16)(H,18,19)/p-1