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

Systemtic Name: 4-[4-ethyl-5-(2-pyridin-4-ylquinazolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[4-ethyl-5-[2-(4-pyridyl)quinazolin-4-yl]sulfanyl-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[4-ethyl-5-[(2-pyridin-4-yl-4-quinazolinyl)thio]-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[4-ethyl-5-(2-pyridin-4-ylquinazolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[4-ethyl-5-[[2-(4-pyridyl)quinazolin-4-yl]thio]-1,2,4-triazol-3-yl]morpholine Formula: C21H21N7OS MolecularWeight: 419.50274

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=NC(=NC3=CC=CC=C32)C4=CC=NC=C4)N5CCOCC5

Isomeric SMILES

CCN1C(=NN=C1SC2=NC(=NC3=CC=CC=C32)C4=CC=NC=C4)N5CCOCC5

InChI

InChI=1S/C21H21N7OS/c1-2-28-20(27-11-13-29-14-12-27)25-26-21(28)30-19-16-5-3-4-6-17(16)23-18(24-19)15-7-9-22-10-8-15/h3-10H,2,11-14H2,1H3