N-[[2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[[2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[[2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[[2-(3,4-dichlorophenyl)-5-methyl-3-pyrazolyl]amino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[[2-(3,4-dichlorophenyl)-5-methylpyrazol-3-yl]carbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[[2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]thiocarbamoyl]-2,2-dimethyl-propionamide Formula: C16H18Cl2N4OS MolecularWeight: 385.31132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=S)NC(=O)C(C)(C)C)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC1=NN(C(=C1)NC(=S)NC(=O)C(C)(C)C)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H18Cl2N4OS/c1-9-7-13(19-15(24)20-14(23)16(2,3)4)22(21-9)10-5-6-11(17)12(18)8-10/h5-8H,1-4H3,(H2,19,20,23,24)