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

Systemtic Name: N-(3-acetamidophenyl)-3-[2-[bis(fluoranyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanamide Openeye Name: N-(3-acetamidophenyl)-3-[2-(difluoromethylsulfanyl)-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanamide CAS Name: N-(3-acetamidophenyl)-3-[2-(difluoromethylthio)-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-(3-acetamidophenyl)-3-[2-(difluoromethylsulfanyl)-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanamide Traditional Name: N-(3-acetamidophenyl)-3-[2-(difluoromethylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]propionamide Formula: C17H18F2N4O3S MolecularWeight: 396.411626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC(F)F)CCC(=O)NC2=CC=CC(=C2)NC(=O)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC(F)F)CCC(=O)NC2=CC=CC(=C2)NC(=O)C

InChI

InChI=1S/C17H18F2N4O3S/c1-9-13(15(26)23-17(20-9)27-16(18)19)6-7-14(25)22-12-5-3-4-11(8-12)21-10(2)24/h3-5,8,16H,6-7H2,1-2H3,(H,21,24)(H,22,25)(H,20,23,26)