3-(5-iodanyl-1,3-benzothiazol-2-yl)-3-oxidanidyl-1-pent-4-enyl-imidazolidin-3-ium-4-ol

Systemtic Name: 3-(5-iodanyl-1,3-benzothiazol-2-yl)-3-oxidanidyl-1-pent-4-enyl-imidazolidin-3-ium-4-ol Openeye Name: 3-(5-iodo-1,3-benzothiazol-2-yl)-3-oxido-1-pent-4-enyl-imidazolidin-3-ium-4-ol CAS Name: 3-(5-iodo-1,3-benzothiazol-2-yl)-3-oxido-1-pent-4-enyl-4-imidazolidin-3-iumol IUPAC Name: 3-(5-iodo-1,3-benzothiazol-2-yl)-3-oxido-1-pent-4-enylimidazolidin-3-ium-4-ol Traditional Name: 3-(5-iodo-1,3-benzothiazol-2-yl)-3-oxido-1-pent-4-enyl-imidazolidin-3-ium-4-ol Formula: C15H18IN3O2S MolecularWeight: 431.29179

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCN1CC([N+](C1)(C2=NC3=C(S2)C=CC(=C3)I)[O-])O

Isomeric SMILES

C=CCCCN1CC([N+](C1)(C2=NC3=C(S2)C=CC(=C3)I)[O-])O

InChI

InChI=1S/C15H18IN3O2S/c1-2-3-4-7-18-9-14(20)19(21,10-18)15-17-12-8-11(16)5-6-13(12)22-15/h2,5-6,8,14,20H,1,3-4,7,9-10H2