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

Systemtic Name: 4-(furan-2-ylmethyl)-3-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-(2-furylmethyl)-3-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-(2-furanylmethyl)-3-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-(furan-2-ylmethyl)-3-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-(2-furfuryl)-3-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]-1H-1,2,4-triazol-5-one Formula: C17H13N3O5S MolecularWeight: 371.36722

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=O)NN=C2SCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

C1=COC(=C1)CN2C(=O)NN=C2SCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C17H13N3O5S/c21-11-3-4-13-10(6-15(22)25-14(13)7-11)9-26-17-19-18-16(23)20(17)8-12-2-1-5-24-12/h1-7,21H,8-9H2,(H,18,23)