N-[2-(4-chloranylphenoxy)ethyl]-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-chloranylphenoxy)ethyl]-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(4-chlorophenoxy)ethyl]-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[2-(4-chlorophenoxy)ethyl]-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[2-(4-chlorophenoxy)ethyl]-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[2-(4-chlorophenoxy)ethyl]-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCOC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClN3O3S/c22-14-5-9-16(10-6-14)28-12-11-23-19(26)13-29-21-24-18-4-2-1-3-17(18)20(27)25(21)15-7-8-15/h1-6,9-10,15H,7-8,11-13H2,(H,23,26)