4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanylmethyl]benzamide

Systemtic Name: 4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanylmethyl]benzamide Openeye Name: 4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanylmethyl]benzamide CAS Name: 4-[[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methylthio]methyl]benzamide IUPAC Name: 4-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylsulfanylmethyl]benzamide Traditional Name: 4-[[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylthio]methyl]benzamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2CSCC3=CC=C(C=C3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2CSCC3=CC=C(C=C3)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O2S/c1-30-23-13-11-19(12-14-23)24-21(15-28(27-24)22-5-3-2-4-6-22)17-31-16-18-7-9-20(10-8-18)25(26)29/h2-15H,16-17H2,1H3,(H2,26,29)