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

Systemtic Name: 4-[4-(methoxymethyl)-1-methyl-6-oxidanylidene-5-(phenylmethyl)pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-[5-benzyl-4-(methoxymethyl)-1-methyl-6-oxo-pyrimidin-2-yl]sulfanyl-butanamide CAS Name: 4-[[4-(methoxymethyl)-1-methyl-6-oxo-5-(phenylmethyl)-2-pyrimidinyl]thio]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-[5-benzyl-4-(methoxymethyl)-1-methyl-6-oxopyrimidin-2-yl]sulfanylbutanamide Traditional Name: N-benzyl-4-[[5-benzyl-6-keto-4-(methoxymethyl)-1-methyl-pyrimidin-2-yl]thio]butyramide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1SCCCC(=O)NCC2=CC=CC=C2)COC)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C(=C(N=C1SCCCC(=O)NCC2=CC=CC=C2)COC)CC3=CC=CC=C3

InChI

InChI=1S/C25H29N3O3S/c1-28-24(30)21(16-19-10-5-3-6-11-19)22(18-31-2)27-25(28)32-15-9-14-23(29)26-17-20-12-7-4-8-13-20/h3-8,10-13H,9,14-18H2,1-2H3,(H,26,29)