3-(diphenylmethyl)-6-methyl-2-phenethylsulfanyl-pyrimidin-4-one

Systemtic Name: 3-(diphenylmethyl)-6-methyl-2-phenethylsulfanyl-pyrimidin-4-one Openeye Name: 3-benzhydryl-6-methyl-2-phenethylsulfanyl-pyrimidin-4-one CAS Name: 3-(diphenylmethyl)-6-methyl-2-(phenethylthio)-4-pyrimidinone IUPAC Name: 3-benzhydryl-6-methyl-2-phenethylsulfanylpyrimidin-4-one Traditional Name: 3-benzhydryl-6-methyl-2-(phenethylthio)pyrimidin-4-one Formula: C26H24N2OS MolecularWeight: 412.54656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCCC2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCCC2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2OS/c1-20-19-24(29)28(26(27-20)30-18-17-21-11-5-2-6-12-21)25(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,19,25H,17-18H2,1H3