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3-(4,5-dihydro-1,3-thiazol-3-ium-2-ylamino)propyl-methyl-(phenylmethyl)azanium

3-(4,5-dihydro-1,3-thiazol-3-ium-2-ylamino)propyl-methyl-(phenylmethyl)azanium

Systemtic Name:3-(4,5-dihydro-1,3-thiazol-3-ium-2-ylamino)propyl-methyl-(phenylmethyl)azanium
Openeye Name:benzyl-[3-(4,5-dihydrothiazol-3-ium-2-ylamino)propyl]-methyl-ammonium
CAS Name:3-(4,5-dihydrothiazol-3-ium-2-ylamino)propyl-methyl-(phenylmethyl)ammonium
IUPAC Name:benzyl-[3-(4,5-dihydro-1,3-thiazol-3-ium-2-ylamino)propyl]-methylazanium
Traditional Name:benzyl-methyl-[3-(2-thiazolin-3-ium-2-ylamino)propyl]ammonium
Formula: C14H23N3S+2
MolecularWeight: 265.41752
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC1=[NH+]CCS1)CC2=CC=CC=C2


Isomeric SMILES

C[NH+](CCCNC1=[NH+]CCS1)CC2=CC=CC=C2


InChI

InChI=1S/C14H21N3S/c1-17(12-13-6-3-2-4-7-13)10-5-8-15-14-16-9-11-18-14/h2-4,6-7H,5,8-12H2,1H3,(H,15,16)/p+2


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