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

Systemtic Name: 3-cyclopropyl-2-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-cyclopropyl-2-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-cyclopropyl-2-[[2-(2,4-dimethylphenyl)-4-oxazolyl]methylthio]-4-quinazolinone IUPAC Name: 3-cyclopropyl-2-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-cyclopropyl-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)N3C5CC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=CO2)CSC3=NC4=CC=CC=C4C(=O)N3C5CC5)C

InChI

InChI=1S/C23H21N3O2S/c1-14-7-10-18(15(2)11-14)21-24-16(12-28-21)13-29-23-25-20-6-4-3-5-19(20)22(27)26(23)17-8-9-17/h3-7,10-12,17H,8-9,13H2,1-2H3