N-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-3-(methylsulfonylamino)benzamide

Systemtic Name: N-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-3-(methylsulfonylamino)benzamide Openeye Name: N-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-(methanesulfonamido)-N-methyl-benzamide CAS Name: N-[[3-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolyl]methyl]-3-(methanesulfonamido)-N-methylbenzamide IUPAC Name: N-[[3-(3,4-dimethylphenyl)-1-phenylpyrazol-4-yl]methyl]-3-(methanesulfonamido)-N-methylbenzamide Traditional Name: N-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-(methanesulfonamido)-N-methyl-benzamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2CN(C)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2CN(C)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H28N4O3S/c1-19-13-14-21(15-20(19)2)26-23(18-31(28-26)25-11-6-5-7-12-25)17-30(3)27(32)22-9-8-10-24(16-22)29-35(4,33)34/h5-16,18,29H,17H2,1-4H3