4-[4-(methoxymethyl)-1-methyl-6-oxidanylidene-5-(phenylmethyl)pyrimidin-2-yl]sulfanyl-N-(2-pyridin-2-ylethyl)butanamide

Systemtic Name: 4-[4-(methoxymethyl)-1-methyl-6-oxidanylidene-5-(phenylmethyl)pyrimidin-2-yl]sulfanyl-N-(2-pyridin-2-ylethyl)butanamide Openeye Name: 4-[5-benzyl-4-(methoxymethyl)-1-methyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-[2-(2-pyridyl)ethyl]butanamide CAS Name: 4-[[4-(methoxymethyl)-1-methyl-6-oxo-5-(phenylmethyl)-2-pyrimidinyl]thio]-N-[2-(2-pyridinyl)ethyl]butanamide IUPAC Name: 4-[5-benzyl-4-(methoxymethyl)-1-methyl-6-oxopyrimidin-2-yl]sulfanyl-N-(2-pyridin-2-ylethyl)butanamide Traditional Name: 4-[[5-benzyl-6-keto-4-(methoxymethyl)-1-methyl-pyrimidin-2-yl]thio]-N-[2-(2-pyridyl)ethyl]butyramide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1SCCCC(=O)NCCC2=CC=CC=N2)COC)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C(=C(N=C1SCCCC(=O)NCCC2=CC=CC=N2)COC)CC3=CC=CC=C3

InChI

InChI=1S/C25H30N4O3S/c1-29-24(31)21(17-19-9-4-3-5-10-19)22(18-32-2)28-25(29)33-16-8-12-23(30)27-15-13-20-11-6-7-14-26-20/h3-7,9-11,14H,8,12-13,15-18H2,1-2H3,(H,27,30)