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

Systemtic Name: 4-[[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[[1-(2,4-dimethylphenyl)-2-imidazolyl]thio]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[[1-(2,4-dimethylphenyl)imidazol-2-yl]thio]methyl]-6,7-dimethyl-coumarin Formula: C23H22N2O2S MolecularWeight: 390.49798

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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)C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O2S/c1-14-5-6-20(17(4)9-14)25-8-7-24-23(25)28-13-18-12-22(26)27-21-11-16(3)15(2)10-19(18)21/h5-12H,13H2,1-4H3