6-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]carbonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[4-[(2-methylthiazol-4-yl)methyl]piperazin-4-ium-1-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[[4-[(2-methyl-4-thiazolyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[4-[(2-methylthiazol-4-yl)methyl]piperazin-4-ium-1-carbonyl]-4H-1,4-benzothiazin-3-one Formula: C18H21N4O2S2+ MolecularWeight: 389.51494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

CC1=NC(=CS1)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C18H20N4O2S2/c1-12-19-14(10-25-12)9-21-4-6-22(7-5-21)18(24)13-2-3-16-15(8-13)20-17(23)11-26-16/h2-3,8,10H,4-7,9,11H2,1H3,(H,20,23)/p+1