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

Systemtic Name: N-[4-(2-methylpropanoylamino)phenyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[4-(2-methylpropanoylamino)phenyl]-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[4-(2-methylpropanoylamino)phenyl]-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[4-(isobutyrylamino)phenyl]-3-(2-thienyl)pyrazole-4-carboxamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2S/c1-17(2)24(30)26-19-10-12-20(13-11-19)27-25(31)21-16-29(15-18-7-4-3-5-8-18)28-23(21)22-9-6-14-32-22/h3-14,16-17H,15H2,1-2H3,(H,26,30)(H,27,31)