N-[2-(2-methylpropanoylamino)ethyl]-2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[2-(2-methylpropanoylamino)ethyl]-2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-2-phenyl-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[2-(2-methylpropanoylamino)ethyl]-2-phenyl-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-2-phenyl-5-(2-thienyl)pyrazole-3-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C20H22N4O2S/c1-14(2)19(25)21-10-11-22-20(26)17-13-16(18-9-6-12-27-18)23-24(17)15-7-4-3-5-8-15/h3-9,12-14H,10-11H2,1-2H3,(H,21,25)(H,22,26)