(2-carbamimidoyl-1,3-benzothiazol-6-yl) benzoate

Systemtic Name: (2-carbamimidoyl-1,3-benzothiazol-6-yl) benzoate Openeye Name: (2-carbamimidoyl-1,3-benzothiazol-6-yl) benzoate CAS Name: benzoic acid (2-carbamimidoyl-1,3-benzothiazol-6-yl) ester IUPAC Name: (2-carbamimidoyl-1,3-benzothiazol-6-yl) benzoate Traditional Name: benzoic acid (2-amidino-1,3-benzothiazol-6-yl) ester Formula: C15H11N3O2S MolecularWeight: 297.33174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11N3O2S/c16-13(17)14-18-11-7-6-10(8-12(11)21-14)20-15(19)9-4-2-1-3-5-9/h1-8H,(H3,16,17)