2-[[5-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[5-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[5-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[5-[(2-ethoxy-4-methylphenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[5-[(2-ethoxy-4-methylphenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[5-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)COC4=C(C=C(C=C4)C)OCC

Isomeric SMILES

CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)COC4=C(C=C(C=C4)C)OCC

InChI

InChI=1S/C23H25N5O3S/c1-4-28-21(13-31-18-11-10-15(3)12-19(18)30-5-2)26-27-23(28)32-14-20-24-17-9-7-6-8-16(17)22(29)25-20/h6-12H,4-5,13-14H2,1-3H3,(H,24,25,29)