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

Systemtic Name: 3-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[(7-ethyl-2-oxo-chromen-4-yl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[(7-ethyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(7-ethyl-2-oxochromen-4-yl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[(7-ethyl-2-keto-chromen-4-yl)methylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O3S/c1-3-7-20-16(22)18-19-17(20)24-10-12-9-15(21)23-14-8-11(4-2)5-6-13(12)14/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,18,22)