N-(6-methoxy-1,3-benzothiazol-2-yl)-2-piperazin-4-ium-1-yl-ethanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-piperazin-4-ium-1-yl-ethanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-piperazin-4-ium-1-yl-acetamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(1-piperazin-4-iumyl)acetamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-piperazin-4-ium-1-ylacetamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-piperazin-4-ium-1-yl-acetamide Formula: C14H19N4O2S+ MolecularWeight: 307.39126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3CC[NH2+]CC3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3CC[NH2+]CC3

InChI

InChI=1S/C14H18N4O2S/c1-20-10-2-3-11-12(8-10)21-14(16-11)17-13(19)9-18-6-4-15-5-7-18/h2-3,8,15H,4-7,9H2,1H3,(H,16,17,19)/p+1