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

Systemtic Name: 2-[4-(methoxymethyl)-1-methyl-6-oxidanylidene-5-(phenylmethyl)pyrimidin-2-yl]sulfanyl-N-pentyl-pentanamide Openeye Name: 2-[5-benzyl-4-(methoxymethyl)-1-methyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-pentyl-pentanamide CAS Name: 2-[[4-(methoxymethyl)-1-methyl-6-oxo-5-(phenylmethyl)-2-pyrimidinyl]thio]-N-pentylpentanamide IUPAC Name: 2-[5-benzyl-4-(methoxymethyl)-1-methyl-6-oxopyrimidin-2-yl]sulfanyl-N-pentylpentanamide Traditional Name: N-amyl-2-[[5-benzyl-6-keto-4-(methoxymethyl)-1-methyl-pyrimidin-2-yl]thio]valeramide Formula: C24H35N3O3S MolecularWeight: 445.618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(CCC)SC1=NC(=C(C(=O)N1C)CC2=CC=CC=C2)COC

Isomeric SMILES

CCCCCNC(=O)C(CCC)SC1=NC(=C(C(=O)N1C)CC2=CC=CC=C2)COC

InChI

InChI=1S/C24H35N3O3S/c1-5-7-11-15-25-22(28)21(12-6-2)31-24-26-20(17-30-4)19(23(29)27(24)3)16-18-13-9-8-10-14-18/h8-10,13-14,21H,5-7,11-12,15-17H2,1-4H3,(H,25,28)