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

Systemtic Name: 7-chloranyl-3-(2-methoxyethyl)-2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-(2-methoxyethyl)-2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(2-methoxyethyl)-2-[(2-methyl-3-nitrophenyl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methoxyethyl)-2-[(2-methyl-3-nitrophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-(2-methoxyethyl)-2-[(2-methyl-3-nitro-benzyl)thio]quinazolin-4-one Formula: C19H18ClN3O4S MolecularWeight: 419.88192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCOC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCOC

InChI

InChI=1S/C19H18ClN3O4S/c1-12-13(4-3-5-17(12)23(25)26)11-28-19-21-16-10-14(20)6-7-15(16)18(24)22(19)8-9-27-2/h3-7,10H,8-9,11H2,1-2H3