(phenylmethyl) 2-(1,3-benzothiazol-6-ylcarbonylamino)ethanoate

Systemtic Name: (phenylmethyl) 2-(1,3-benzothiazol-6-ylcarbonylamino)ethanoate Openeye Name: benzyl 2-(1,3-benzothiazole-6-carbonylamino)acetate CAS Name: 2-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(1,3-benzothiazole-6-carbonylamino)acetate Traditional Name: 2-(1,3-benzothiazole-6-carbonylamino)acetic acid benzyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CNC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CNC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C17H14N2O3S/c20-16(22-10-12-4-2-1-3-5-12)9-18-17(21)13-6-7-14-15(8-13)23-11-19-14/h1-8,11H,9-10H2,(H,18,21)