N-[2,5-bis(chloranyl)phenyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[2,5-bis(chloranyl)phenyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2,5-dichlorophenyl)propanamide CAS Name: N-(2,5-dichlorophenyl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(2,5-dichlorophenyl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(2,5-dichlorophenyl)propionamide Formula: C20H17Cl2N3O2S MolecularWeight: 434.33888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)Cl)Cl)SC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)Cl)Cl)SC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C20H17Cl2N3O2S/c1-3-10-25-19(27)14-6-4-5-7-16(14)24-20(25)28-12(2)18(26)23-17-11-13(21)8-9-15(17)22/h3-9,11-12H,1,10H2,2H3,(H,23,26)