5-(1,3-benzothiazol-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)furan-2-carboxamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)furan-2-carboxamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)furan-2-carboxamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methyl-1-piperazin-4-iumyl)-2-furancarboxamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)furan-2-carboxamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)-2-furamide Formula: C17H19N4O2S+ MolecularWeight: 343.42336

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=CC=C(O2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=CC=C(O2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H18N4O2S/c1-20-8-10-21(11-9-20)19-16(22)13-6-7-14(23-13)17-18-12-4-2-3-5-15(12)24-17/h2-7H,8-11H2,1H3,(H,19,22)/p+1