N-(1,3-benzothiazol-2-ylmethyl)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-methyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-methyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C19H25N4O2S+ MolecularWeight: 373.4924

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C[NH+]3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C[NH+]3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C19H24N4O2S/c1-21(12-17-20-15-4-2-3-5-16(15)26-17)18(24)13-22-8-10-23(11-9-22)19(25)14-6-7-14/h2-5,14H,6-13H2,1H3/p+1