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[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate

[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name:[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate
Openeye Name:[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate
CAS Name:2-(methylthio)-3-pyridinecarboxylic acid [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxoethyl] ester
IUPAC Name:[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
Traditional Name:2-(methylthio)nicotinic acid [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-keto-ethyl] ester
Formula: C18H17N3O3S2
MolecularWeight: 387.47588
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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)COC(=O)C3=C(N=CC=C3)SC


Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)COC(=O)C3=C(N=CC=C3)SC


InChI

InChI=1S/C18H17N3O3S2/c1-21(10-15-20-13-7-3-4-8-14(13)26-15)16(22)11-24-18(23)12-6-5-9-19-17(12)25-2/h3-9H,10-11H2,1-2H3


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