3-(3-ethyl-4-methyl-1,2-thiazol-5-yl)-1-(3-methylbut-3-enyl)-1-prop-2-enyl-1,3,5-triazinan-1-ium-2-one

Systemtic Name: 3-(3-ethyl-4-methyl-1,2-thiazol-5-yl)-1-(3-methylbut-3-enyl)-1-prop-2-enyl-1,3,5-triazinan-1-ium-2-one Openeye Name: 1-allyl-3-(3-ethyl-4-methyl-isothiazol-5-yl)-1-(3-methylbut-3-enyl)-1,3,5-triazinan-1-ium-2-one CAS Name: 3-(3-ethyl-4-methyl-5-isothiazolyl)-1-(3-methylbut-3-enyl)-1-prop-2-enyl-1,3,5-triazinan-1-ium-2-one IUPAC Name: 3-(3-ethyl-4-methyl-1,2-thiazol-5-yl)-1-(3-methylbut-3-enyl)-1-prop-2-enyl-1,3,5-triazinan-1-ium-2-one Traditional Name: 1-allyl-3-(3-ethyl-4-methyl-isothiazol-5-yl)-1-(3-methylbut-3-enyl)-1,3,5-triazinan-1-ium-2-one Formula: C17H27N4OS+ MolecularWeight: 335.48748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NSC(=C1C)N2CNC[N+](C2=O)(CCC(=C)C)CC=C

Isomeric SMILES

CCC1=NSC(=C1C)N2CNC[N+](C2=O)(CCC(=C)C)CC=C

InChI

InChI=1S/C17H27N4OS/c1-6-9-21(10-8-13(3)4)12-18-11-20(17(21)22)16-14(5)15(7-2)19-23-16/h6,18H,1,3,7-12H2,2,4-5H3/q+1