2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-6-[[(1R)-1,2-bis(oxidanyl)ethyl]amino]-4-oxidanylidene-1H-pyrimidine-5-carboxamide

Systemtic Name: 2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-6-[[(1R)-1,2-bis(oxidanyl)ethyl]amino]-4-oxidanylidene-1H-pyrimidine-5-carboxamide Openeye Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-6-[[(1R)-1,2-dihydroxyethyl]amino]-4-oxo-1H-pyrimidine-5-carboxamide CAS Name: 2-[(2,3-difluorophenyl)methylthio]-6-[[(1R)-1,2-dihydroxyethyl]amino]-4-oxo-1H-pyrimidine-5-carboxamide IUPAC Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-6-[[(1R)-1,2-dihydroxyethyl]amino]-4-oxo-1H-pyrimidine-5-carboxamide Traditional Name: 2-[(2,3-difluorobenzyl)thio]-6-[[(1R)-1,2-dihydroxyethyl]amino]-4-keto-1H-pyrimidine-5-carboxamide Formula: C14H14F2N4O4S MolecularWeight: 372.347166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)F)CSC2=NC(=O)C(=C(N2)NC(CO)O)C(=O)N

Isomeric SMILES

C1=CC(=C(C(=C1)F)F)CSC2=NC(=O)C(=C(N2)N[C@@H](CO)O)C(=O)N

InChI

InChI=1S/C14H14F2N4O4S/c15-7-3-1-2-6(10(7)16)5-25-14-19-12(18-8(22)4-21)9(11(17)23)13(24)20-14/h1-3,8,21-22H,4-5H2,(H2,17,23)(H2,18,19,20,24)/t8-/m1/s1