1,3-benzothiazol-2-ylmethyl 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[2-(dimethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=CC=CC=C1C(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(C)C(=O)CSC1=CC=CC=C1C(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H18N2O3S2/c1-21(2)18(22)12-25-15-9-5-3-7-13(15)19(23)24-11-17-20-14-8-4-6-10-16(14)26-17/h3-10H,11-12H2,1-2H3