5-[(4-chloranylpyrazol-1-yl)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]furan-2-carboxamide

Systemtic Name: 5-[(4-chloranylpyrazol-1-yl)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]furan-2-carboxamide Openeye Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]furan-2-carboxamide CAS Name: 5-[(4-chloro-1-pyrazolyl)methyl]-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-furancarboxamide IUPAC Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]furan-2-carboxamide Traditional Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-furamide Formula: C20H23ClN5O2+ MolecularWeight: 400.88192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)CN4C=C(C=N4)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)CN4C=C(C=N4)Cl

InChI

InChI=1S/C20H22ClN5O2/c1-24-8-10-25(11-9-24)17-4-2-16(3-5-17)23-20(27)19-7-6-18(28-19)14-26-13-15(21)12-22-26/h2-7,12-13H,8-11,14H2,1H3,(H,23,27)/p+1