2-[2-[(3-methoxyphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(pyridin-4-ylmethyl)ethanamide

Systemtic Name: 2-[2-[(3-methoxyphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[2-[(3-methoxyphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[2-[(3-methoxyphenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[2-[(3-methoxyphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[4-keto-2-(m-anisylthio)-1H-pyrimidin-6-yl]-N-(4-pyridylmethyl)acetamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC(=O)C=C(N2)CC(=O)NCC3=CC=NC=C3

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC(=O)C=C(N2)CC(=O)NCC3=CC=NC=C3

InChI

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