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

Systemtic Name: 4-chloranyl-N-[3-cyano-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-[3-cyano-4-(4-isobutylphenyl)-2-thienyl]-2-methyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-[3-cyano-4-[4-(2-methylpropyl)phenyl]-2-thiophenyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-[3-cyano-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]-2-methylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-[3-cyano-4-(4-isobutylphenyl)-2-thienyl]-2-methyl-pyrazole-3-carboxamide Formula: C20H19ClN4OS MolecularWeight: 398.90906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)C3=C(C=NN3C)Cl

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)C3=C(C=NN3C)Cl

InChI

InChI=1S/C20H19ClN4OS/c1-12(2)8-13-4-6-14(7-5-13)16-11-27-20(15(16)9-22)24-19(26)18-17(21)10-23-25(18)3/h4-7,10-12H,8H2,1-3H3,(H,24,26)