1-butyl-3-oxidanidyl-3-(6-pentyl-1,3-benzothiazol-2-yl)imidazolidin-3-ium-4-ol

Systemtic Name: 1-butyl-3-oxidanidyl-3-(6-pentyl-1,3-benzothiazol-2-yl)imidazolidin-3-ium-4-ol Openeye Name: 1-butyl-3-oxido-3-(6-pentyl-1,3-benzothiazol-2-yl)imidazolidin-3-ium-4-ol CAS Name: 1-butyl-3-oxido-3-(6-pentyl-1,3-benzothiazol-2-yl)-4-imidazolidin-3-iumol IUPAC Name: 1-butyl-3-oxido-3-(6-pentyl-1,3-benzothiazol-2-yl)imidazolidin-3-ium-4-ol Traditional Name: 3-(6-amyl-1,3-benzothiazol-2-yl)-1-butyl-3-oxido-imidazolidin-3-ium-4-ol Formula: C19H29N3O2S MolecularWeight: 363.51746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=C1)N=C(S2)[N+]3(CN(CC3O)CCCC)[O-]

Isomeric SMILES

CCCCCC1=CC2=C(C=C1)N=C(S2)[N+]3(CN(CC3O)CCCC)[O-]

InChI

InChI=1S/C19H29N3O2S/c1-3-5-7-8-15-9-10-16-17(12-15)25-19(20-16)22(24)14-21(11-6-4-2)13-18(22)23/h9-10,12,18,23H,3-8,11,13-14H2,1-2H3