2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-[3-[methyl(phenyl)amino]propyl]ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-[3-[methyl(phenyl)amino]propyl]ethanamide Openeye Name: 2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-[3-(N-methylanilino)propyl]acetamide CAS Name: 2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-[3-(N-methylanilino)propyl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-[3-(N-methylanilino)propyl]acetamide Traditional Name: 2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]-N-[3-(N-methylanilino)propyl]acetamide Formula: C23H25ClN4O2S MolecularWeight: 456.9882

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC=C)C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC=C)C3=CC=CC=C3

InChI

InChI=1S/C23H25ClN4O2S/c1-3-13-28-22(30)19-11-10-17(24)15-20(19)26-23(28)31-16-21(29)25-12-7-14-27(2)18-8-5-4-6-9-18/h3-6,8-11,15H,1,7,12-14,16H2,2H3,(H,25,29)