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

Systemtic Name: 4-[1,4-dimethyl-5-[(3-methylphenyl)methyl]-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(4-methylphenyl)butanamide Openeye Name: 4-[1,4-dimethyl-5-(m-tolylmethyl)-6-oxo-pyrimidin-2-yl]sulfanyl-N-(p-tolyl)butanamide CAS Name: 4-[[1,4-dimethyl-5-[(3-methylphenyl)methyl]-6-oxo-2-pyrimidinyl]thio]-N-(4-methylphenyl)butanamide IUPAC Name: 4-[1,4-dimethyl-5-[(3-methylphenyl)methyl]-6-oxopyrimidin-2-yl]sulfanyl-N-(4-methylphenyl)butanamide Traditional Name: 4-[[6-keto-1,4-dimethyl-5-(3-methylbenzyl)pyrimidin-2-yl]thio]-N-(p-tolyl)butyramide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCCSC2=NC(=C(C(=O)N2C)CC3=CC=CC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCCSC2=NC(=C(C(=O)N2C)CC3=CC=CC(=C3)C)C

InChI

InChI=1S/C25H29N3O2S/c1-17-10-12-21(13-11-17)27-23(29)9-6-14-31-25-26-19(3)22(24(30)28(25)4)16-20-8-5-7-18(2)15-20/h5,7-8,10-13,15H,6,9,14,16H2,1-4H3,(H,27,29)