4,7-dimethyl-2-piperazin-4-ium-1-yl-1,3-benzothiazole

Systemtic Name: 4,7-dimethyl-2-piperazin-4-ium-1-yl-1,3-benzothiazole Openeye Name: 4,7-dimethyl-2-piperazin-4-ium-1-yl-1,3-benzothiazole CAS Name: 4,7-dimethyl-2-(1-piperazin-4-iumyl)-1,3-benzothiazole IUPAC Name: 4,7-dimethyl-2-piperazin-4-ium-1-yl-1,3-benzothiazole Traditional Name: 4,7-dimethyl-2-piperazin-4-ium-1-yl-1,3-benzothiazole Formula: C13H18N3S+ MolecularWeight: 248.36712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)N3CC[NH2+]CC3

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N3CC[NH2+]CC3

InChI

InChI=1S/C13H17N3S/c1-9-3-4-10(2)12-11(9)15-13(17-12)16-7-5-14-6-8-16/h3-4,14H,5-8H2,1-2H3/p+1