N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[(3-fluoro-4-methoxy-phenyl)methyl]-N-methyl-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-(3-fluoro-4-methoxy-benzyl)-3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]-N-methyl-propionamide Formula: C18H22FN3O3S MolecularWeight: 379.448983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)N(C)CC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)N(C)CC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C18H22FN3O3S/c1-11-13(17(24)21-18(20-11)26-4)6-8-16(23)22(2)10-12-5-7-15(25-3)14(19)9-12/h5,7,9H,6,8,10H2,1-4H3,(H,20,21,24)