7,8-dimethyl-4-[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 7,8-dimethyl-4-[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7,8-dimethyl-4-[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7,8-dimethyl-4-[[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7,8-dimethyl-4-[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7,8-dimethyl-4-[[[5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]methyl]coumarin Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=NN=C(O2)SCC3=CC(=O)OC4=C3C=CC(=C4C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=NN=C(O2)SCC3=CC(=O)OC4=C3C=CC(=C4C)C

InChI

InChI=1S/C22H20N2O4S/c1-13-5-4-6-17(9-13)26-11-19-23-24-22(27-19)29-12-16-10-20(25)28-21-15(3)14(2)7-8-18(16)21/h4-10H,11-12H2,1-3H3