(2-carbamimidoyl-1,3-benzothiazol-6-yl) thiophene-2-carboxylate

Systemtic Name: (2-carbamimidoyl-1,3-benzothiazol-6-yl) thiophene-2-carboxylate Openeye Name: (2-carbamimidoyl-1,3-benzothiazol-6-yl) thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid (2-carbamimidoyl-1,3-benzothiazol-6-yl) ester IUPAC Name: (2-carbamimidoyl-1,3-benzothiazol-6-yl) thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid (2-amidino-1,3-benzothiazol-6-yl) ester Formula: C13H9N3O2S2 MolecularWeight: 303.35946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)OC2=CC3=C(C=C2)N=C(S3)C(=N)N

Isomeric SMILES

C1=CSC(=C1)C(=O)OC2=CC3=C(C=C2)N=C(S3)C(=N)N

InChI

InChI=1S/C13H9N3O2S2/c14-11(15)12-16-8-4-3-7(6-10(8)20-12)18-13(17)9-2-1-5-19-9/h1-6H,(H3,14,15)