5-methyl-3-(phenylmethyl)-6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-pyrimidine-2,4-dione

Systemtic Name: 5-methyl-3-(phenylmethyl)-6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-pyrimidine-2,4-dione Openeye Name: 3-benzyl-5-methyl-6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-pyrimidine-2,4-dione CAS Name: 5-methyl-3-(phenylmethyl)-6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]-1H-pyrimidine-2,4-dione IUPAC Name: 3-benzyl-5-methyl-6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-pyrimidine-2,4-dione Traditional Name: 3-benzyl-5-methyl-6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]uracil Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)N(C1=O)CC2=CC=CC=C2)SCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(NC(=O)N(C1=O)CC2=CC=CC=C2)SCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O3S/c1-14-19(23-21(27)25(20(14)26)12-15-8-4-2-5-9-15)29-13-17-22-18(24-28-17)16-10-6-3-7-11-16/h2-11H,12-13H2,1H3,(H,23,27)