1-(3,4-dimethoxyphenyl)-2-(5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,4-dimethoxyphenyl)-2-(5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dimethoxyphenyl)-2-(5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl-ethanone CAS Name: 1-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)thio]ethanone IUPAC Name: 1-(3,4-dimethoxyphenyl)-2-(5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanylethanone Traditional Name: 1-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)thio]ethanone Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(=C1)SCC(=O)C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C=NN2C(=C1)SCC(=O)C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O3S/c1-15-11-22(26-23(25-15)18(13-24-26)16-7-5-4-6-8-16)30-14-19(27)17-9-10-20(28-2)21(12-17)29-3/h4-13H,14H2,1-3H3