N-(2,6-dimethylphenyl)-2-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methylthio]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylsulfanyl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylthio]acetamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSCC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSCC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2S/c1-19-8-7-9-20(2)26(19)28-25(31)18-33-17-22-16-30(23-10-5-4-6-11-23)29-27(22)21-12-14-24(32-3)15-13-21/h4-16H,17-18H2,1-3H3,(H,28,31)