4-[[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanylmethyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanylmethyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[(1-isobutyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[[4,5-dimethyl-1-(2-methylpropyl)-2-imidazolyl]thio]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanylmethyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[(1-isobutyl-4,5-dimethyl-imidazol-2-yl)thio]methyl]-6,7-dimethyl-coumarin Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC(=C(N3CC(C)C)C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC(=C(N3CC(C)C)C)C)C

InChI

InChI=1S/C21H26N2O2S/c1-12(2)10-23-16(6)15(5)22-21(23)26-11-17-9-20(24)25-19-8-14(4)13(3)7-18(17)19/h7-9,12H,10-11H2,1-6H3