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

Systemtic Name: 2-morpholin-4-ium-4-yl-6-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-(4-benzylpiperazin-4-ium-1-carbonyl)-2-morpholin-4-ium-4-yl-4H-1,4-benzothiazin-3-one CAS Name: 2-(4-morpholin-4-iumyl)-6-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-(4-benzylpiperazin-4-ium-1-carbonyl)-2-morpholin-4-ium-4-yl-4H-1,4-benzothiazin-3-one Traditional Name: 6-(4-benzylpiperazin-4-ium-1-carbonyl)-2-morpholin-4-ium-4-yl-4H-1,4-benzothiazin-3-one Formula: C24H30N4O3S+2 MolecularWeight: 454.585

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)SC(C(=O)N4)[NH+]5CCOCC5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)SC(C(=O)N4)[NH+]5CCOCC5

InChI

InChI=1S/C24H28N4O3S/c29-22-24(28-12-14-31-15-13-28)32-21-7-6-19(16-20(21)25-22)23(30)27-10-8-26(9-11-27)17-18-4-2-1-3-5-18/h1-7,16,24H,8-15,17H2,(H,25,29)/p+2