6-(4-methylpiperazin-4-ium-1-yl)carbonyl-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-(4-methylpiperazin-4-ium-1-yl)carbonyl-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one Openeye Name: 6-(4-methylpiperazin-4-ium-1-carbonyl)-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one CAS Name: 6-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-2-(1-piperidin-1-iumyl)-4H-1,4-benzothiazin-3-one IUPAC Name: 6-(4-methylpiperazin-4-ium-1-carbonyl)-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one Traditional Name: 6-(4-methylpiperazin-4-ium-1-carbonyl)-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one Formula: C19H28N4O2S+2 MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC3=C(C=C2)SC(C(=O)N3)[NH+]4CCCCC4

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC3=C(C=C2)SC(C(=O)N3)[NH+]4CCCCC4

InChI

InChI=1S/C19H26N4O2S/c1-21-9-11-22(12-10-21)18(25)14-5-6-16-15(13-14)20-17(24)19(26-16)23-7-3-2-4-8-23/h5-6,13,19H,2-4,7-12H2,1H3,(H,20,24)/p+2