4-[[5-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[5-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 4-[[5-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-7-hydroxy-chromen-2-one CAS Name: 4-[[[5-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[5-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-7-hydroxychromen-2-one Traditional Name: 4-[[[5-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]methyl]-7-hydroxy-coumarin Formula: C24H25N3O6S MolecularWeight: 483.5368

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COCCCN1C(=NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C24H25N3O6S/c1-30-10-4-9-27-23(15-5-8-19(31-2)21(11-15)32-3)25-26-24(27)34-14-16-12-22(29)33-20-13-17(28)6-7-18(16)20/h5-8,11-13,28H,4,9-10,14H2,1-3H3