6-piperazin-4-ium-1-yl-2-propyl-1,3-benzothiazole

Systemtic Name: 6-piperazin-4-ium-1-yl-2-propyl-1,3-benzothiazole Openeye Name: 6-piperazin-4-ium-1-yl-2-propyl-1,3-benzothiazole CAS Name: 6-(1-piperazin-4-iumyl)-2-propyl-1,3-benzothiazole IUPAC Name: 6-piperazin-4-ium-1-yl-2-propyl-1,3-benzothiazole Traditional Name: 6-piperazin-4-ium-1-yl-2-propyl-1,3-benzothiazole Formula: C14H20N3S+ MolecularWeight: 262.3937

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(S1)C=C(C=C2)N3CC[NH2+]CC3

Isomeric SMILES

CCCC1=NC2=C(S1)C=C(C=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C14H19N3S/c1-2-3-14-16-12-5-4-11(10-13(12)18-14)17-8-6-15-7-9-17/h4-5,10,15H,2-3,6-9H2,1H3/p+1