N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl]-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridinamine IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-amine Traditional Name: [5-(1,3-benzothiazol-2-yl)-2-furyl]methyl-[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]amine Formula: C22H24N5O3S2+ MolecularWeight: 470.58766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NCC3=CC=C(O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NCC3=CC=C(O3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H23N5O3S2/c1-26-10-12-27(13-11-26)32(28,29)17-7-9-21(24-15-17)23-14-16-6-8-19(30-16)22-25-18-4-2-3-5-20(18)31-22/h2-9,15H,10-14H2,1H3,(H,23,24)/p+1