N-[(2S)-butan-2-yl]-2-(3,4-dichlorophenyl)-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-(3,4-dichlorophenyl)-5-phenyl-pyrazole-3-carboxamide Openeye Name: 2-(3,4-dichlorophenyl)-N-[(1S)-1-methylpropyl]-5-phenyl-pyrazole-3-carboxamide CAS Name: N-[(2S)-butan-2-yl]-2-(3,4-dichlorophenyl)-5-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-2-(3,4-dichlorophenyl)-5-phenylpyrazole-3-carboxamide Traditional Name: 2-(3,4-dichlorophenyl)-N-[(1S)-1-methylpropyl]-5-phenyl-pyrazole-3-carboxamide Formula: C20H19Cl2N3O MolecularWeight: 388.29036

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NN1C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC(=NN1C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H19Cl2N3O/c1-3-13(2)23-20(26)19-12-18(14-7-5-4-6-8-14)24-25(19)15-9-10-16(21)17(22)11-15/h4-13H,3H2,1-2H3,(H,23,26)/t13-/m0/s1