2-tert-butyl-6-piperazin-4-ium-1-yl-1,3-benzothiazole

Systemtic Name: 2-tert-butyl-6-piperazin-4-ium-1-yl-1,3-benzothiazole Openeye Name: 2-tert-butyl-6-piperazin-4-ium-1-yl-1,3-benzothiazole CAS Name: 2-tert-butyl-6-(1-piperazin-4-iumyl)-1,3-benzothiazole IUPAC Name: 2-tert-butyl-6-piperazin-4-ium-1-yl-1,3-benzothiazole Traditional Name: 2-tert-butyl-6-piperazin-4-ium-1-yl-1,3-benzothiazole Formula: C15H22N3S+ MolecularWeight: 276.42028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(S1)C=C(C=C2)N3CC[NH2+]CC3

Isomeric SMILES

CC(C)(C)C1=NC2=C(S1)C=C(C=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C15H21N3S/c1-15(2,3)14-17-12-5-4-11(10-13(12)19-14)18-8-6-16-7-9-18/h4-5,10,16H,6-9H2,1-3H3/p+1