2-[4-(diphenylmethyl)oxybutylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(diphenylmethyl)oxybutylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(4-benzhydryloxybutylsulfanyl)-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[4-(diphenylmethyl)oxybutylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(4-benzhydryloxybutylsulfanyl)-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(4-benzhydryloxybutylthio)-6-methyl-1H-pyrimidin-4-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCCCCOC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCCCCOC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O2S/c1-17-16-20(25)24-22(23-17)27-15-9-8-14-26-21(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-7,10-13,16,21H,8-9,14-15H2,1H3,(H,23,24,25)