4-chloranyl-N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-[3-cyano-4-(4-isobutylphenyl)-5-methyl-2-thienyl]-2-methyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]-2-thiophenyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-[3-cyano-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2-methylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-[3-cyano-4-(4-isobutylphenyl)-5-methyl-2-thienyl]-2-methyl-pyrazole-3-carboxamide Formula: C21H21ClN4OS MolecularWeight: 412.93564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=C(C=NN2C)Cl)C#N)C3=CC=C(C=C3)CC(C)C

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=C(C=NN2C)Cl)C#N)C3=CC=C(C=C3)CC(C)C

InChI

InChI=1S/C21H21ClN4OS/c1-12(2)9-14-5-7-15(8-6-14)18-13(3)28-21(16(18)10-23)25-20(27)19-17(22)11-24-26(19)4/h5-8,11-12H,9H2,1-4H3,(H,25,27)