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1,3-benzothiazol-2-ylmethyl-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium

1,3-benzothiazol-2-ylmethyl-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name:1,3-benzothiazol-2-ylmethyl-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium
Openeye Name:1,3-benzothiazol-2-ylmethyl-methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]ammonium
CAS Name:1,3-benzothiazol-2-ylmethyl-methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]ammonium
IUPAC Name:1,3-benzothiazol-2-ylmethyl-methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]azanium
Traditional Name:1,3-benzothiazol-2-ylmethyl-[2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-ammonium
Formula: C18H20N3OS2+
MolecularWeight: 358.5009
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=CC=C3SC


Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=CC=C3SC


InChI

InChI=1S/C18H19N3OS2/c1-21(12-18-20-14-8-4-6-10-16(14)24-18)11-17(22)19-13-7-3-5-9-15(13)23-2/h3-10H,11-12H2,1-2H3,(H,19,22)/p+1


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