N-(2-cyanophenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-propanamide

Systemtic Name: N-(2-cyanophenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-propanamide Openeye Name: N-(2-cyanophenyl)-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-propanamide CAS Name: N-(2-cyanophenyl)-2-[[2-(2-furanyl)-4-quinazolinyl]thio]propanamide IUPAC Name: N-(2-cyanophenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylpropanamide Traditional Name: N-(2-cyanophenyl)-2-[[2-(2-furyl)quinazolin-4-yl]thio]propionamide Formula: C22H16N4O2S MolecularWeight: 400.45304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)SC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C#N)SC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C22H16N4O2S/c1-14(21(27)25-17-9-4-2-7-15(17)13-23)29-22-16-8-3-5-10-18(16)24-20(26-22)19-11-6-12-28-19/h2-12,14H,1H3,(H,25,27)