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methyl N-(2-methyl-1-thianthren-5-ium-5-yl-propan-2-yl)propanimidate

methyl N-(2-methyl-1-thianthren-5-ium-5-yl-propan-2-yl)propanimidate

Systemtic Name:methyl N-(2-methyl-1-thianthren-5-ium-5-yl-propan-2-yl)propanimidate
Openeye Name:methyl N-(1,1-dimethyl-2-thianthren-5-ium-5-yl-ethyl)propanimidate
CAS Name:N-[2-methyl-1-(5-thianthren-5-iumyl)propan-2-yl]propanimidic acid methyl ester
IUPAC Name:methyl N-(2-methyl-1-thianthren-5-ium-5-ylpropan-2-yl)propanimidate
Traditional Name:N-(1,1-dimethyl-2-thianthren-5-ium-5-yl-ethyl)propionimidic acid methyl ester
Formula: C20H24NOS2+
MolecularWeight: 358.54066
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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NC(C)(C)C[S+]1C2=CC=CC=C2SC3=CC=CC=C31)OC


Isomeric SMILES

CCC(=NC(C)(C)C[S+]1C2=CC=CC=C2SC3=CC=CC=C31)OC


InChI

InChI=1S/C20H24NOS2/c1-5-19(22-4)21-20(2,3)14-24-17-12-8-6-10-15(17)23-16-11-7-9-13-18(16)24/h6-13H,5,14H2,1-4H3/q+1


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