7-chloranyl-3-(3,5-dimethylphenyl)-2-(hexylsulfanylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(3,5-dimethylphenyl)-2-(hexylsulfanylmethyl)quinazolin-4-one Openeye Name: 7-chloro-3-(3,5-dimethylphenyl)-2-(hexylsulfanylmethyl)quinazolin-4-one CAS Name: 7-chloro-3-(3,5-dimethylphenyl)-2-[(hexylthio)methyl]-4-quinazolinone IUPAC Name: 7-chloro-3-(3,5-dimethylphenyl)-2-(hexylsulfanylmethyl)quinazolin-4-one Traditional Name: 7-chloro-3-(3,5-dimethylphenyl)-2-[(hexylthio)methyl]quinazolin-4-one Formula: C23H27ClN2OS MolecularWeight: 414.99128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSCC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCCCSCC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC(=CC(=C3)C)C

InChI

InChI=1S/C23H27ClN2OS/c1-4-5-6-7-10-28-15-22-25-21-14-18(24)8-9-20(21)23(27)26(22)19-12-16(2)11-17(3)13-19/h8-9,11-14H,4-7,10,15H2,1-3H3