2-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 2-[[2-(2,4-dimethylphenyl)-4-oxazolyl]methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methylthio]quinazolin-4-one Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC(=CO2)CSC3=NC4=CC=CC=C4C(=O)N3CC=C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=CO2)CSC3=NC4=CC=CC=C4C(=O)N3CC=C)C

InChI

InChI=1S/C23H21N3O2S/c1-4-11-26-22(27)19-7-5-6-8-20(19)25-23(26)29-14-17-13-28-21(24-17)18-10-9-15(2)12-16(18)3/h4-10,12-13H,1,11,14H2,2-3H3