N-[2-(2-methylpropanoylamino)ethyl]-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(2-methylpropanoylamino)ethyl]-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-[2-(2-methylpropanoylamino)ethyl]-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

InChI

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