6-tert-butyl-3-methyl-2-[(3-methylphenyl)methylsulfanyl]pyrimidin-4-one

Systemtic Name: 6-tert-butyl-3-methyl-2-[(3-methylphenyl)methylsulfanyl]pyrimidin-4-one Openeye Name: 6-tert-butyl-3-methyl-2-(m-tolylmethylsulfanyl)pyrimidin-4-one CAS Name: 6-tert-butyl-3-methyl-2-[(3-methylphenyl)methylthio]-4-pyrimidinone IUPAC Name: 6-tert-butyl-3-methyl-2-[(3-methylphenyl)methylsulfanyl]pyrimidin-4-one Traditional Name: 6-tert-butyl-3-methyl-2-[(3-methylbenzyl)thio]pyrimidin-4-one Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC(=CC(=O)N2C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC(=CC(=O)N2C)C(C)(C)C

InChI

InChI=1S/C17H22N2OS/c1-12-7-6-8-13(9-12)11-21-16-18-14(17(2,3)4)10-15(20)19(16)5/h6-10H,11H2,1-5H3