4-[[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[4-(difluoromethylsulfanyl)anilino]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[4-(difluoromethylthio)anilino]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[4-(difluoromethylsulfanyl)anilino]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[4-(difluoromethylthio)anilino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C18H15F2NO3S MolecularWeight: 363.378406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CNC3=CC=C(C=C3)SC(F)F)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CNC3=CC=C(C=C3)SC(F)F)O

InChI

InChI=1S/C18H15F2NO3S/c1-10-15(22)7-6-14-11(8-16(23)24-17(10)14)9-21-12-2-4-13(5-3-12)25-18(19)20/h2-8,18,21-22H,9H2,1H3