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2-[(R)-1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methyl]-1,3-thiazole

2-[(R)-1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methyl]-1,3-thiazole

Systemtic Name:2-[(R)-1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methyl]-1,3-thiazole
Openeye Name:2-[(R)-1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methyl]thiazole
CAS Name:2-[(R)-1,3-benzodioxol-5-yl(1-piperazin-4-iumyl)methyl]thiazole
IUPAC Name:2-[(R)-1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methyl]-1,3-thiazole
Traditional Name:2-[(R)-1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methyl]thiazole
Formula: C15H18N3O2S+
MolecularWeight: 304.38732
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(C2=CC3=C(C=C2)OCO3)C4=NC=CS4


Isomeric SMILES

C1CN(CC[NH2+]1)[C@H](C2=CC3=C(C=C2)OCO3)C4=NC=CS4


InChI

InChI=1S/C15H17N3O2S/c1-2-12-13(20-10-19-12)9-11(1)14(15-17-5-8-21-15)18-6-3-16-4-7-18/h1-2,5,8-9,14,16H,3-4,6-7,10H2/p+1/t14-/m1/s1


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