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

Systemtic Name: 4-(3-methoxypropyl)-3-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 3-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one CAS Name: 3-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one Traditional Name: 3-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

COCCCN1C(=O)NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C16H17N3O5S/c1-23-6-2-5-19-15(22)17-18-16(19)25-9-10-7-14(21)24-13-8-11(20)3-4-12(10)13/h3-4,7-8,20H,2,5-6,9H2,1H3,(H,17,22)