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

Systemtic Name: 3-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[(7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[(7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(7-methyl-2-oxochromen-4-yl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[(2-keto-7-methyl-chromen-4-yl)methylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O3S/c1-3-6-19-15(21)17-18-16(19)23-9-11-8-14(20)22-13-7-10(2)4-5-12(11)13/h4-5,7-8H,3,6,9H2,1-2H3,(H,17,21)