N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2-(3-oxo-1,4-benzothiazin-4-yl)acetamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]-2-(3-oxo-1,4-benzothiazin-4-yl)acetamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]-2-(3-oxo-1,4-benzothiazin-4-yl)acetamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2-(3-keto-1,4-benzothiazin-4-yl)acetamide Formula: C23H29N4O2S+ MolecularWeight: 425.56696

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CN3C(=O)CSC4=CC=CC=C43)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CN3C(=O)CSC4=CC=CC=C43)C

InChI

InChI=1S/C23H28N4O2S/c1-3-25-10-12-26(13-11-25)18-8-9-19(17(2)14-18)24-22(28)15-27-20-6-4-5-7-21(20)30-16-23(27)29/h4-9,14H,3,10-13,15-16H2,1-2H3,(H,24,28)/p+1