6-chloranyl-4-[[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-[[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[[1-(2,4-dimethylphenyl)-2-imidazolyl]thio]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[[1-(2,4-dimethylphenyl)imidazol-2-yl]thio]methyl]-7-methyl-coumarin Formula: C22H19ClN2O2S MolecularWeight: 410.91646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CN=C2SCC3=CC(=O)OC4=CC(=C(C=C34)Cl)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CN=C2SCC3=CC(=O)OC4=CC(=C(C=C34)Cl)C)C

InChI

InChI=1S/C22H19ClN2O2S/c1-13-4-5-19(15(3)8-13)25-7-6-24-22(25)28-12-16-10-21(26)27-20-9-14(2)18(23)11-17(16)20/h4-11H,12H2,1-3H3