5-chloranyl-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[[2-(4-methyl-1-piperazin-4-iumyl)-3-pyridin-1-iumyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]thiophene-2-carboxamide Formula: C16H21ClN4OS+2 MolecularWeight: 352.88214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=CC=[NH+]2)CNC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=CC=[NH+]2)CNC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H19ClN4OS/c1-20-7-9-21(10-8-20)15-12(3-2-6-18-15)11-19-16(22)13-4-5-14(17)23-13/h2-6H,7-11H2,1H3,(H,19,22)/p+2