2-[[3,4-bis(fluoranyl)phenyl]sulfanylmethyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[3,4-bis(fluoranyl)phenyl]sulfanylmethyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one Openeye Name: 2-[(3,4-difluorophenyl)sulfanylmethyl]-1H-benzofuro[3,2-d]pyrimidin-4-one CAS Name: 2-[[(3,4-difluorophenyl)thio]methyl]-1H-benzofuro[3,2-d]pyrimidin-4-one IUPAC Name: 2-[(3,4-difluorophenyl)sulfanylmethyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one Traditional Name: 2-[[(3,4-difluorophenyl)thio]methyl]-1H-benzofuro[3,2-d]pyrimidin-4-one Formula: C17H10F2N2O2S MolecularWeight: 344.335306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=O)N=C(N3)CSC4=CC(=C(C=C4)F)F

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=O)N=C(N3)CSC4=CC(=C(C=C4)F)F

InChI

InChI=1S/C17H10F2N2O2S/c18-11-6-5-9(7-12(11)19)24-8-14-20-15-10-3-1-2-4-13(10)23-16(15)17(22)21-14/h1-7H,8H2,(H,20,21,22)