2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[2-[(3-methoxyphenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[4-keto-2-(m-anisylthio)-6-methyl-1H-pyrimidin-5-yl]-N-(3-pyridylmethyl)acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC(=CC=C2)OC)CC(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC(=CC=C2)OC)CC(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C21H22N4O3S/c1-14-18(10-19(26)23-12-16-6-4-8-22-11-16)20(27)25-21(24-14)29-13-15-5-3-7-17(9-15)28-2/h3-9,11H,10,12-13H2,1-2H3,(H,23,26)(H,24,25,27)