5,5-dimethyl-2-(2-methylprop-2-enylsulfanyl)-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one

Systemtic Name: 5,5-dimethyl-2-(2-methylprop-2-enylsulfanyl)-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one Openeye Name: 3-allyl-5,5-dimethyl-2-(2-methylallylsulfanyl)-6H-benzo[h]quinazolin-4-one CAS Name: 5,5-dimethyl-2-(2-methylprop-2-enylthio)-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one IUPAC Name: 5,5-dimethyl-2-(2-methylprop-2-enylsulfanyl)-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one Traditional Name: 3-allyl-5,5-dimethyl-2-(2-methylallylthio)-6H-benzo[h]quinazolin-4-one Formula: C21H24N2OS MolecularWeight: 352.49306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NC2=C(C(=O)N1CC=C)C(CC3=CC=CC=C32)(C)C

Isomeric SMILES

CC(=C)CSC1=NC2=C(C(=O)N1CC=C)C(CC3=CC=CC=C32)(C)C

InChI

InChI=1S/C21H24N2OS/c1-6-11-23-19(24)17-18(22-20(23)25-13-14(2)3)16-10-8-7-9-15(16)12-21(17,4)5/h6-10H,1-2,11-13H2,3-5H3