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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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