1-(chloromethyl)-3-[7-(chloromethyl)-1,3-benzothiazol-2-yl]-3-oxidanidyl-N-pent-4-enyl-imidazolidin-3-ium-4-amine

Systemtic Name: 1-(chloromethyl)-3-[7-(chloromethyl)-1,3-benzothiazol-2-yl]-3-oxidanidyl-N-pent-4-enyl-imidazolidin-3-ium-4-amine Openeye Name: 1-(chloromethyl)-3-[7-(chloromethyl)-1,3-benzothiazol-2-yl]-3-oxido-N-pent-4-enyl-imidazolidin-3-ium-4-amine CAS Name: 1-(chloromethyl)-3-[7-(chloromethyl)-1,3-benzothiazol-2-yl]-3-oxido-N-pent-4-enyl-4-imidazolidin-3-iumamine IUPAC Name: 1-(chloromethyl)-3-[7-(chloromethyl)-1,3-benzothiazol-2-yl]-3-oxido-N-pent-4-enylimidazolidin-3-ium-4-amine Traditional Name: [1-(chloromethyl)-3-[7-(chloromethyl)-1,3-benzothiazol-2-yl]-3-oxido-imidazolidin-3-ium-4-yl]-pent-4-enyl-amine Formula: C17H22Cl2N4OS MolecularWeight: 401.35378

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCNC1CN(C[N+]1(C2=NC3=CC=CC(=C3S2)CCl)[O-])CCl

Isomeric SMILES

C=CCCCNC1CN(C[N+]1(C2=NC3=CC=CC(=C3S2)CCl)[O-])CCl

InChI

InChI=1S/C17H22Cl2N4OS/c1-2-3-4-8-20-15-10-22(11-19)12-23(15,24)17-21-14-7-5-6-13(9-18)16(14)25-17/h2,5-7,15,20H,1,3-4,8-12H2