N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-4-[(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide

Systemtic Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-4-[(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide Openeye Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide CAS Name: N-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]-4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide IUPAC Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide Traditional Name: 4-[(3-keto-4H-1,4-benzothiazin-2-ylidene)methyl]-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]benzamide Formula: C24H30N4O2S+2 MolecularWeight: 438.5856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCNC(=O)C2=CC=C(C=C2)C=C3C(=O)NC4=CC=CC=C4S3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCNC(=O)C2=CC=C(C=C2)C=C3C(=O)NC4=CC=CC=C4S3

InChI

InChI=1S/C24H28N4O2S/c1-27-13-15-28(16-14-27)12-4-11-25-23(29)19-9-7-18(8-10-19)17-22-24(30)26-20-5-2-3-6-21(20)31-22/h2-3,5-10,17H,4,11-16H2,1H3,(H,25,29)(H,26,30)/p+2