1-(4-chlorophenyl)-5-(furan-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]pyrazole-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-5-(furan-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]pyrazole-3-carboxamide Openeye Name: 1-(4-chlorophenyl)-5-(2-furyl)-N-[2-(2-methylpropanoylamino)ethyl]pyrazole-3-carboxamide CAS Name: 1-(4-chlorophenyl)-5-(2-furanyl)-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-3-pyrazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-5-(furan-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]pyrazole-3-carboxamide Traditional Name: 1-(4-chlorophenyl)-5-(2-furyl)-N-[2-(isobutyrylamino)ethyl]pyrazole-3-carboxamide Formula: C20H21ClN4O3 MolecularWeight: 400.85874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=NN(C(=C1)C2=CC=CO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=NN(C(=C1)C2=CC=CO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN4O3/c1-13(2)19(26)22-9-10-23-20(27)16-12-17(18-4-3-11-28-18)25(24-16)15-7-5-14(21)6-8-15/h3-8,11-13H,9-10H2,1-2H3,(H,22,26)(H,23,27)