3-(1,3-benzothiazol-2-yl)-N-(butoxymethyl)-1-but-3-ynyl-3-oxidanidyl-imidazolidin-3-ium-4-amine

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-(butoxymethyl)-1-but-3-ynyl-3-oxidanidyl-imidazolidin-3-ium-4-amine Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-(butoxymethyl)-1-but-3-ynyl-3-oxido-imidazolidin-3-ium-4-amine CAS Name: 3-(1,3-benzothiazol-2-yl)-N-(butoxymethyl)-1-but-3-ynyl-3-oxido-4-imidazolidin-3-iumamine IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-(butoxymethyl)-1-but-3-ynyl-3-oxidoimidazolidin-3-ium-4-amine Traditional Name: [3-(1,3-benzothiazol-2-yl)-1-but-3-ynyl-3-oxido-imidazolidin-3-ium-4-yl]-(butoxymethyl)amine Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCNC1CN(C[N+]1(C2=NC3=CC=CC=C3S2)[O-])CCC#C

Isomeric SMILES

CCCCOCNC1CN(C[N+]1(C2=NC3=CC=CC=C3S2)[O-])CCC#C

InChI

InChI=1S/C19H26N4O2S/c1-3-5-11-22-13-18(20-14-25-12-6-4-2)23(24,15-22)19-21-16-9-7-8-10-17(16)26-19/h1,7-10,18,20H,4-6,11-15H2,2H3