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

Systemtic Name: N-[3,5-bis(fluoranyl)phenyl]-3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-(3,5-difluorophenyl)-3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-(3,5-difluorophenyl)-3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide IUPAC Name: N-(3,5-difluorophenyl)-3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide Traditional Name: N-(3,5-difluorophenyl)-3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propionamide Formula: C14H13F2N3O2S MolecularWeight: 325.333726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13F2N3O2S/c1-7-11(13(21)19-14(22)17-7)2-3-12(20)18-10-5-8(15)4-9(16)6-10/h4-6H,2-3H2,1H3,(H,18,20)(H2,17,19,21,22)