7-chloranyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-7-chloro-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-2-[(3-methyl-2-quinoxalinyl)methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 7-chloro-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-7-chloro-2-[(3-methylquinoxalin-2-yl)methylthio]quinazolin-4-one Formula: C21H17ClN4OS MolecularWeight: 408.90388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC=C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC=C

InChI

InChI=1S/C21H17ClN4OS/c1-3-10-26-20(27)15-9-8-14(22)11-18(15)25-21(26)28-12-19-13(2)23-16-6-4-5-7-17(16)24-19/h3-9,11H,1,10,12H2,2H3