4-[[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methoxy]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methoxy]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[[4-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methoxy]chromen-2-one CAS Name: 7-hydroxy-4-[[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methoxy]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methoxy]chromen-2-one Traditional Name: 7-hydroxy-4-[[4-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methoxy]coumarin Formula: C19H15N3O5S MolecularWeight: 397.4045

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NNC2=S)COC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NNC2=S)COC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C19H15N3O5S/c1-25-13-5-2-11(3-6-13)22-17(20-21-19(22)28)10-26-15-9-18(24)27-16-8-12(23)4-7-14(15)16/h2-9,23H,10H2,1H3,(H,21,28)