N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)ethanamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)ethanamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-2-(3-oxo-4H-1,4-benzothiazin-2-ylidene)acetamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]propyl]-2-(3-oxo-4H-1,4-benzothiazin-2-ylidene)acetamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-2-(3-oxo-4H-1,4-benzothiazin-2-ylidene)acetamide Traditional Name: 2-(3-keto-4H-1,4-benzothiazin-2-ylidene)-N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]acetamide Formula: C24H29N4O3S+ MolecularWeight: 453.57706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)CCCNC(=O)C=C3C(=O)NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)CCCNC(=O)C=C3C(=O)NC4=CC=CC=C4S3

InChI

InChI=1S/C24H28N4O3S/c1-31-19-9-7-18(8-10-19)28-15-13-27(14-16-28)12-4-11-25-23(29)17-22-24(30)26-20-5-2-3-6-21(20)32-22/h2-3,5-10,17H,4,11-16H2,1H3,(H,25,29)(H,26,30)/p+1