2-[5-methoxy-4-oxidanylidene-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[5-methoxy-4-oxidanylidene-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[5-methoxy-4-oxo-2-(pyrimidin-2-ylsulfanylmethyl)-1-pyridyl]acetamide CAS Name: 2-[5-methoxy-4-oxo-2-[(2-pyrimidinylthio)methyl]-1-pyridinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[5-methoxy-4-oxo-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-keto-5-methoxy-2-[(2-pyrimidylthio)methyl]-1-pyridyl]acetamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(C(=CC1=O)CSC2=NC=CC=N2)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CN(C(=CC1=O)CSC2=NC=CC=N2)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3S/c1-27-18-12-24(13-19(26)23-11-15-6-3-2-4-7-15)16(10-17(18)25)14-28-20-21-8-5-9-22-20/h2-10,12H,11,13-14H2,1H3,(H,23,26)