2-[[3-(diphenylmethyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-1H-pyrimidin-4-one

Systemtic Name: 2-[[3-(diphenylmethyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-1H-pyrimidin-4-one Openeye Name: 2-[(3-benzhydryl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5,6-dimethyl-1H-pyrimidin-4-one CAS Name: 2-[[3-(diphenylmethyl)-1,2,4-oxadiazol-5-yl]methylthio]-5,6-dimethyl-1H-pyrimidin-4-one IUPAC Name: 2-[(3-benzhydryl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5,6-dimethyl-1H-pyrimidin-4-one Traditional Name: 2-[(3-benzhydryl-1,2,4-oxadiazol-5-yl)methylthio]-5,6-dimethyl-1H-pyrimidin-4-one Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SCC2=NC(=NO2)C(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(NC(=NC1=O)SCC2=NC(=NO2)C(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H20N4O2S/c1-14-15(2)23-22(25-21(14)27)29-13-18-24-20(26-28-18)19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,19H,13H2,1-2H3,(H,23,25,27)