3-(6-chloranyl-1,3-benzothiazol-2-yl)-3-oxidanidyl-1-prop-2-enyl-imidazolidin-3-ium-4-ol

Systemtic Name: 3-(6-chloranyl-1,3-benzothiazol-2-yl)-3-oxidanidyl-1-prop-2-enyl-imidazolidin-3-ium-4-ol Openeye Name: 1-allyl-3-(6-chloro-1,3-benzothiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol CAS Name: 3-(6-chloro-1,3-benzothiazol-2-yl)-3-oxido-1-prop-2-enyl-4-imidazolidin-3-iumol IUPAC Name: 3-(6-chloro-1,3-benzothiazol-2-yl)-3-oxido-1-prop-2-enylimidazolidin-3-ium-4-ol Traditional Name: 1-allyl-3-(6-chloro-1,3-benzothiazol-2-yl)-3-oxido-imidazolidin-3-ium-4-ol Formula: C13H14ClN3O2S MolecularWeight: 311.78716

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CC([N+](C1)(C2=NC3=C(S2)C=C(C=C3)Cl)[O-])O

Isomeric SMILES

C=CCN1CC([N+](C1)(C2=NC3=C(S2)C=C(C=C3)Cl)[O-])O

InChI

InChI=1S/C13H14ClN3O2S/c1-2-5-16-7-12(18)17(19,8-16)13-15-10-4-3-9(14)6-11(10)20-13/h2-4,6,12,18H,1,5,7-8H2