8-methyl-7-oxidanyl-4-[[1-(phenylmethyl)imidazol-2-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 8-methyl-7-oxidanyl-4-[[1-(phenylmethyl)imidazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 4-[(1-benzylimidazol-2-yl)sulfanylmethyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 7-hydroxy-8-methyl-4-[[[1-(phenylmethyl)-2-imidazolyl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 4-[(1-benzylimidazol-2-yl)sulfanylmethyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[(1-benzylimidazol-2-yl)thio]methyl]-7-hydroxy-8-methyl-coumarin Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NC=CN3CC4=CC=CC=C4)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NC=CN3CC4=CC=CC=C4)O

InChI

InChI=1S/C21H18N2O3S/c1-14-18(24)8-7-17-16(11-19(25)26-20(14)17)13-27-21-22-9-10-23(21)12-15-5-3-2-4-6-15/h2-11,24H,12-13H2,1H3