N-[2-(2-chlorophenyl)-4-(4-methylpiperazin-4-ium-1-yl)carbonyl-pyrazol-3-yl]furan-2-carboxamide

Systemtic Name: N-[2-(2-chlorophenyl)-4-(4-methylpiperazin-4-ium-1-yl)carbonyl-pyrazol-3-yl]furan-2-carboxamide Openeye Name: N-[2-(2-chlorophenyl)-4-(4-methylpiperazin-4-ium-1-carbonyl)pyrazol-3-yl]furan-2-carboxamide CAS Name: N-[2-(2-chlorophenyl)-4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-3-pyrazolyl]-2-furancarboxamide IUPAC Name: N-[2-(2-chlorophenyl)-4-(4-methylpiperazin-4-ium-1-carbonyl)pyrazol-3-yl]furan-2-carboxamide Traditional Name: N-[2-(2-chlorophenyl)-4-(4-methylpiperazin-4-ium-1-carbonyl)pyrazol-3-yl]-2-furamide Formula: C20H21ClN5O3+ MolecularWeight: 414.86544

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3Cl)NC(=O)C4=CC=CO4

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3Cl)NC(=O)C4=CC=CO4

InChI

InChI=1S/C20H20ClN5O3/c1-24-8-10-25(11-9-24)20(28)14-13-22-26(16-6-3-2-5-15(16)21)18(14)23-19(27)17-7-4-12-29-17/h2-7,12-13H,8-11H2,1H3,(H,23,27)/p+1