N-[3,5-bis(chloranyl)pyridin-2-yl]-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[3,5-bis(chloranyl)pyridin-2-yl]-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3,5-dichloro-2-pyridyl)-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(3,5-dichloro-2-pyridinyl)-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(3,5-dichloropyridin-2-yl)-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(3,5-dichloro-2-pyridyl)-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C22H24Cl2N4O2S MolecularWeight: 479.42256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=C(C=C(C=N3)Cl)Cl

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=C(C=C(C=N3)Cl)Cl

InChI

InChI=1S/C22H24Cl2N4O2S/c1-3-4-5-8-11-28-21(30)16-9-6-7-10-18(16)26-22(28)31-14(2)20(29)27-19-17(24)12-15(23)13-25-19/h6-7,9-10,12-14H,3-5,8,11H2,1-2H3,(H,25,27,29)