2-[[5-(1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4a,8a-dihydro-3H-quinazolin-4-one

Systemtic Name: 2-[[5-(1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4a,8a-dihydro-3H-quinazolin-4-one Openeye Name: 2-[[5-(benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4a,8a-dihydro-3H-quinazolin-4-one CAS Name: 2-[[[5-(2-benzofuranyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-4a,8a-dihydro-3H-quinazolin-4-one IUPAC Name: 2-[[5-(1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4a,8a-dihydro-3H-quinazolin-4-one Traditional Name: 2-[[[5-(benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-4a,8a-dihydro-3H-quinazolin-4-one Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=NC3C=CC=CC3C(=O)N2)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CN1C(=NN=C1SCC2=NC3C=CC=CC3C(=O)N2)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C20H17N5O2S/c1-25-18(16-10-12-6-2-5-9-15(12)27-16)23-24-20(25)28-11-17-21-14-8-4-3-7-13(14)19(26)22-17/h2-10,13-14H,11H2,1H3,(H,21,22,26)