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

Systemtic Name: N-[3,5-bis(chloranyl)pyridin-2-yl]-2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3,5-dichloro-2-pyridyl)acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-(3,5-dichloro-2-pyridinyl)acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-(3,5-dichloropyridin-2-yl)acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-(3,5-dichloro-2-pyridyl)acetamide Formula: C19H18Cl2N4O2S MolecularWeight: 437.34282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=N3)Cl)Cl

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=N3)Cl)Cl

InChI

InChI=1S/C19H18Cl2N4O2S/c1-2-3-8-25-18(27)13-6-4-5-7-15(13)23-19(25)28-11-16(26)24-17-14(21)9-12(20)10-22-17/h4-7,9-10H,2-3,8,11H2,1H3,(H,22,24,26)