6-chloranyl-2-[(2,5-dimethylphenyl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(2,5-dimethylphenyl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one Openeye Name: 6-chloro-2-[(2,5-dimethylphenyl)methylsulfanyl]-3-isobutyl-quinazolin-4-one CAS Name: 6-chloro-2-[(2,5-dimethylphenyl)methylthio]-3-(2-methylpropyl)-4-quinazolinone IUPAC Name: 6-chloro-2-[(2,5-dimethylphenyl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one Traditional Name: 6-chloro-2-[(2,5-dimethylbenzyl)thio]-3-isobutyl-quinazolin-4-one Formula: C21H23ClN2OS MolecularWeight: 386.93812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC(C)C

InChI

InChI=1S/C21H23ClN2OS/c1-13(2)11-24-20(25)18-10-17(22)7-8-19(18)23-21(24)26-12-16-9-14(3)5-6-15(16)4/h5-10,13H,11-12H2,1-4H3