2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: 2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-cyclopropyl-2-phenyl-acetamide CAS Name: 2-[[7-chloro-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-cyclopropyl-2-phenylacetamide Traditional Name: 2-[[7-chloro-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C3=CC=CC=C3)C(=O)NC4CC4

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C3=CC=CC=C3)C(=O)NC4CC4

InChI

InChI=1S/C22H22ClN3O3S/c1-29-12-11-26-21(28)17-10-7-15(23)13-18(17)25-22(26)30-19(14-5-3-2-4-6-14)20(27)24-16-8-9-16/h2-7,10,13,16,19H,8-9,11-12H2,1H3,(H,24,27)