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

Systemtic Name: 3-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C15H15N3O4S MolecularWeight: 333.3623

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CCCN1C(=O)NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C15H15N3O4S/c1-2-5-18-14(21)16-17-15(18)23-8-9-6-13(20)22-12-7-10(19)3-4-11(9)12/h3-4,6-7,19H,2,5,8H2,1H3,(H,16,21)