5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]thiophene-2-carboxylate

Systemtic Name: 5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]thiophene-2-carboxylate Openeye Name: 5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]thiophene-2-carboxylate CAS Name: 5-[(1Z)-1-(1,3-benzothiazol-2-ylhydrazinylidene)ethyl]-2-thiophenecarboxylate IUPAC Name: 5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methylcarbonimidoyl]thiophene-2-carboxylate Traditional Name: 5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]-2-thenoate Formula: C14H10N3O2S2- MolecularWeight: 316.3781

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=CC=CC=C2S1)C3=CC=C(S3)C(=O)[O-]

Isomeric SMILES

C/C(=N/NC1=NC2=CC=CC=C2S1)/C3=CC=C(S3)C(=O)[O-]

InChI

InChI=1S/C14H11N3O2S2/c1-8(10-6-7-12(20-10)13(18)19)16-17-14-15-9-4-2-3-5-11(9)21-14/h2-7H,1H3,(H,15,17)(H,18,19)/p-1/b16-8-