4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]-1H-1,2,4-triazol-5-one Formula: C20H15N3O6S MolecularWeight: 425.4146

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SCC4=CC(=O)OC5=C4C=CC(=C5)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SCC4=CC(=O)OC5=C4C=CC(=C5)O

InChI

InChI=1S/C20H15N3O6S/c24-13-2-3-14-11(7-18(25)29-16(14)9-13)10-30-20-22-21-19(26)23(20)12-1-4-15-17(8-12)28-6-5-27-15/h1-4,7-9,24H,5-6,10H2,(H,21,26)