4-methyl-7-[2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethoxy]chromen-2-one

Systemtic Name: 4-methyl-7-[2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethoxy]chromen-2-one Openeye Name: 7-[2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethoxy]-4-methyl-chromen-2-one CAS Name: 4-methyl-7-[2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]ethoxy]-1-benzopyran-2-one IUPAC Name: 7-[2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethoxy]-4-methylchromen-2-one Traditional Name: 7-[2-[(5-benzyl-1,3,4-oxadiazol-2-yl)thio]ethoxy]-4-methyl-coumarin Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCCSC3=NN=C(O3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCCSC3=NN=C(O3)CC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O4S/c1-14-11-20(24)26-18-13-16(7-8-17(14)18)25-9-10-28-21-23-22-19(27-21)12-15-5-3-2-4-6-15/h2-8,11,13H,9-10,12H2,1H3