1,3-benzothiazol-2-ylmethyl 2-[(2-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[(2-cyanophenyl)sulfonylamino]ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[(2-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[(2-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C17H13N3O4S2 MolecularWeight: 387.43282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)S(=O)(=O)NCC(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C(=C1)C#N)S(=O)(=O)NCC(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H13N3O4S2/c18-9-12-5-1-4-8-15(12)26(22,23)19-10-17(21)24-11-16-20-13-6-2-3-7-14(13)25-16/h1-8,19H,10-11H2