3-(2,4-dimethoxyphenyl)-N-(3-methylsulfanylphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(2,4-dimethoxyphenyl)-N-(3-methylsulfanylphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(2,4-dimethoxyphenyl)-N-(3-methylsulfanylphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(2,4-dimethoxyphenyl)-N-[3-(methylthio)phenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(2,4-dimethoxyphenyl)-N-(3-methylsulfanylphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(2,4-dimethoxyphenyl)-N-[3-(methylthio)phenyl]-1-phenyl-pyrazole-4-carboxamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NN(C=C2C(=O)NC3=CC(=CC=C3)SC)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NN(C=C2C(=O)NC3=CC(=CC=C3)SC)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H23N3O3S/c1-30-19-12-13-21(23(15-19)31-2)24-22(16-28(27-24)18-9-5-4-6-10-18)25(29)26-17-8-7-11-20(14-17)32-3/h4-16H,1-3H3,(H,26,29)