3-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-5-one Openeye Name: 3-[(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-4-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-1,2,4-triazol-5-one CAS Name: 3-[(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-[[(2R)-2-oxolanyl]methyl]-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(7-hydroxy-8-methyl-2-oxochromen-4-yl)methylsulfanyl]-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-5-one Traditional Name: 3-[(7-hydroxy-2-keto-8-methyl-chromen-4-yl)methylthio]-4-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-1,2,4-triazol-5-one Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NNC(=O)N3CC4CCCO4)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NNC(=O)N3C[C@H]4CCCO4)O

InChI

InChI=1S/C18H19N3O5S/c1-10-14(22)5-4-13-11(7-15(23)26-16(10)13)9-27-18-20-19-17(24)21(18)8-12-3-2-6-25-12/h4-5,7,12,22H,2-3,6,8-9H2,1H3,(H,19,24)/t12-/m1/s1