2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: 2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-acetamide CAS Name: 2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: 2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-cyclopropyl-2-phenylacetamide Traditional Name: 2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C3=CC=CC=C3)C(=O)NC4CC4

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C3=CC=CC=C3)C(=O)NC4CC4

InChI

InChI=1S/C22H20ClN3O2S/c1-2-12-26-21(28)17-11-8-15(23)13-18(17)25-22(26)29-19(14-6-4-3-5-7-14)20(27)24-16-9-10-16/h2-8,11,13,16,19H,1,9-10,12H2,(H,24,27)