2-[(3,5-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[(3,5-dimethylphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 2-[(3,5-dimethylphenyl)methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[(3,5-dimethylbenzyl)thio]quinazolin-4-one Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC=C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC=C)C

InChI

InChI=1S/C20H20N2OS/c1-4-9-22-19(23)17-7-5-6-8-18(17)21-20(22)24-13-16-11-14(2)10-15(3)12-16/h4-8,10-12H,1,9,13H2,2-3H3