7-chloranyl-3-(2-methoxyethyl)-2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methoxyethyl)-2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-(2-methoxyethyl)-2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(2-methoxyethyl)-2-[(2-methoxy-5-nitrophenyl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methoxyethyl)-2-[(2-methoxy-5-nitrophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-(2-methoxyethyl)-2-[(2-methoxy-5-nitro-benzyl)thio]quinazolin-4-one Formula: C19H18ClN3O5S MolecularWeight: 435.88132

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H18ClN3O5S/c1-27-8-7-22-18(24)15-5-3-13(20)10-16(15)21-19(22)29-11-12-9-14(23(25)26)4-6-17(12)28-2/h3-6,9-10H,7-8,11H2,1-2H3