2-[1,3-benzodioxol-5-yl(piperazin-1-yl)methyl]-1,3-benzothiazole

Systemtic Name: 2-[1,3-benzodioxol-5-yl(piperazin-1-yl)methyl]-1,3-benzothiazole Openeye Name: 2-[1,3-benzodioxol-5-yl(piperazin-1-yl)methyl]-1,3-benzothiazole CAS Name: 2-[1,3-benzodioxol-5-yl(1-piperazinyl)methyl]-1,3-benzothiazole IUPAC Name: 2-[1,3-benzodioxol-5-yl(piperazin-1-yl)methyl]-1,3-benzothiazole Traditional Name: 2-[1,3-benzodioxol-5-yl(piperazino)methyl]-1,3-benzothiazole Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(C2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1)C(C2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C19H19N3O2S/c1-2-4-17-14(3-1)21-19(25-17)18(22-9-7-20-8-10-22)13-5-6-15-16(11-13)24-12-23-15/h1-6,11,18,20H,7-10,12H2