4-[[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]sulfanylmethyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]sulfanylmethyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[[1-(difluoromethyl)benzimidazol-2-yl]sulfanylmethyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[[1-(difluoromethyl)-2-benzimidazolyl]thio]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[1-(difluoromethyl)benzimidazol-2-yl]sulfanylmethyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[[1-(difluoromethyl)benzimidazol-2-yl]thio]methyl]-6,7-dimethyl-coumarin Formula: C20H16F2N2O2S MolecularWeight: 386.415046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3C(F)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3C(F)F)C

InChI

InChI=1S/C20H16F2N2O2S/c1-11-7-14-13(9-18(25)26-17(14)8-12(11)2)10-27-20-23-15-5-3-4-6-16(15)24(20)19(21)22/h3-9,19H,10H2,1-2H3