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

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]propionamide Formula: C20H20FN5O3S2 MolecularWeight: 461.532903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NC2=NC(=CS2)C3=C(C=C(C=C3)NC(=O)C)F

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NC2=NC(=CS2)C3=C(C=C(C=C3)NC(=O)C)F

InChI

InChI=1S/C20H20FN5O3S2/c1-10-13(18(29)26-19(22-10)30-3)6-7-17(28)25-20-24-16(9-31-20)14-5-4-12(8-15(14)21)23-11(2)27/h4-5,8-9H,6-7H2,1-3H3,(H,23,27)(H,22,26,29)(H,24,25,28)