4-[[4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-2-pyridin-3-yl-quinazoline

Systemtic Name: 4-[[4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-2-pyridin-3-yl-quinazoline Openeye Name: 4-[[4-ethyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]sulfanyl]-2-(3-pyridyl)quinazoline CAS Name: 4-[[4-ethyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]-2-(3-pyridinyl)quinazoline IUPAC Name: 4-[[4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-2-pyridin-3-ylquinazoline Traditional Name: 4-[[4-ethyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]thio]-2-(3-pyridyl)quinazoline Formula: C22H18N6OS MolecularWeight: 414.48292

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)C5=C(OC=C5)C

Isomeric SMILES

CCN1C(=NN=C1SC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)C5=C(OC=C5)C

InChI

InChI=1S/C22H18N6OS/c1-3-28-20(16-10-12-29-14(16)2)26-27-22(28)30-21-17-8-4-5-9-18(17)24-19(25-21)15-7-6-11-23-13-15/h4-13H,3H2,1-2H3