5-(4-chlorophenyl)-4-methyl-4-(3-methylsulfanylpropyl)-N-(4-methylsulfonylphenyl)-3H-pyrazole-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-4-methyl-4-(3-methylsulfanylpropyl)-N-(4-methylsulfonylphenyl)-3H-pyrazole-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-4-methyl-4-(3-methylsulfanylpropyl)-N-(4-methylsulfonylphenyl)-3H-pyrazole-2-carboxamide CAS Name: 5-(4-chlorophenyl)-4-methyl-N-(4-methylsulfonylphenyl)-4-[3-(methylthio)propyl]-3H-pyrazole-2-carboxamide IUPAC Name: 5-(4-chlorophenyl)-4-methyl-4-(3-methylsulfanylpropyl)-N-(4-methylsulfonylphenyl)-3H-pyrazole-2-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-(4-mesylphenyl)-4-methyl-4-[3-(methylthio)propyl]-2-pyrazoline-1-carboxamide Formula: C22H26ClN3O3S2 MolecularWeight: 480.04314

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)S(=O)(=O)C)CCCSC

Isomeric SMILES

CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)S(=O)(=O)C)CCCSC

InChI

InChI=1S/C22H26ClN3O3S2/c1-22(13-4-14-30-2)15-26(25-20(22)16-5-7-17(23)8-6-16)21(27)24-18-9-11-19(12-10-18)31(3,28)29/h5-12H,4,13-15H2,1-3H3,(H,24,27)