[2-(1,3-benzothiazol-2-yl)pyridin-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2-(1,3-benzothiazol-2-yl)pyridin-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [2-(1,3-benzothiazol-2-yl)-3-pyridyl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [2-(1,3-benzothiazol-2-yl)-3-pyridinyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2-(1,3-benzothiazol-2-yl)pyridin-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [2-(1,3-benzothiazol-2-yl)-3-pyridyl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C18H19N4OS+ MolecularWeight: 339.43466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4OS/c1-21-9-11-22(12-10-21)18(23)13-5-4-8-19-16(13)17-20-14-6-2-3-7-15(14)24-17/h2-8H,9-12H2,1H3/p+1