(2E)-3-methyl-2-[(E)-3-(3-methyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)prop-2-enylidene]-1,3-thiazolidine; methyl sulfate

Systemtic Name: (2E)-3-methyl-2-[(E)-3-(3-methyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)prop-2-enylidene]-1,3-thiazolidine; methyl sulfate Openeye Name: (2E)-3-methyl-2-[(E)-3-(3-methyl-4,5-dihydrothiazol-3-ium-2-yl)prop-2-enylidene]thiazolidine; methyl sulfate CAS Name: (2E)-3-methyl-2-[(E)-3-(3-methyl-4,5-dihydrothiazol-3-ium-2-yl)prop-2-enylidene]thiazolidine; methyl sulfate IUPAC Name: (2E)-3-methyl-2-[(E)-3-(3-methyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)prop-2-enylidene]-1,3-thiazolidine; methyl sulfate Traditional Name: 3-methyl-2-[(E,3E)-3-(3-methylthiazolidin-2-ylidene)prop-1-enyl]-2-thiazolin-3-ium; methyl sulfate Formula: C12H20N2O4S3 MolecularWeight: 352.4932

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCSC1=CC=CC2=[N+](CCS2)C.COS(=O)(=O)[O-]

Isomeric SMILES

CN\1CCS/C1=C/C=C/C2=[N+](CCS2)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C11H17N2S2.CH4O4S/c1-12-6-8-14-10(12)4-3-5-11-13(2)7-9-15-11;1-5-6(2,3)4/h3-5H,6-9H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1