2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C19H18N6O2S MolecularWeight: 394.45022

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC=NC=C4

Isomeric SMILES

COCCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC=NC=C4

InChI

InChI=1S/C19H18N6O2S/c1-27-11-10-25-17(13-6-8-20-9-7-13)23-24-19(25)28-12-16-21-15-5-3-2-4-14(15)18(26)22-16/h2-9H,10-12H2,1H3,(H,21,22,26)