4-[1,4-dimethyl-5-[(3-methylphenyl)methyl]-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(4-fluorophenyl)butanamide

Systemtic Name: 4-[1,4-dimethyl-5-[(3-methylphenyl)methyl]-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(4-fluorophenyl)butanamide Openeye Name: 4-[1,4-dimethyl-5-(m-tolylmethyl)-6-oxo-pyrimidin-2-yl]sulfanyl-N-(4-fluorophenyl)butanamide CAS Name: 4-[[1,4-dimethyl-5-[(3-methylphenyl)methyl]-6-oxo-2-pyrimidinyl]thio]-N-(4-fluorophenyl)butanamide IUPAC Name: 4-[1,4-dimethyl-5-[(3-methylphenyl)methyl]-6-oxopyrimidin-2-yl]sulfanyl-N-(4-fluorophenyl)butanamide Traditional Name: N-(4-fluorophenyl)-4-[[6-keto-1,4-dimethyl-5-(3-methylbenzyl)pyrimidin-2-yl]thio]butyramide Formula: C24H26FN3O2S MolecularWeight: 439.545543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=C(N=C(N(C2=O)C)SCCCC(=O)NC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=C(N=C(N(C2=O)C)SCCCC(=O)NC3=CC=C(C=C3)F)C

InChI

InChI=1S/C24H26FN3O2S/c1-16-6-4-7-18(14-16)15-21-17(2)26-24(28(3)23(21)30)31-13-5-8-22(29)27-20-11-9-19(25)10-12-20/h4,6-7,9-12,14H,5,8,13,15H2,1-3H3,(H,27,29)