3-(2-methoxy-5-methyl-phenyl)-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methoxy-5-methyl-phenyl)-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2-methoxy-5-methyl-phenyl)-2-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-methoxy-5-methylphenyl)-2-[[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(2-methoxy-5-methylphenyl)-2-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]sulfanylquinazolin-4-one Traditional Name: 2-[(2-keto-2-mesityl-ethyl)thio]-3-(2-methoxy-5-methyl-phenyl)quinazolin-4-one Formula: C27H26N2O3S MolecularWeight: 458.57194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=C(C=C(C=C4C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=C(C=C(C=C4C)C)C

InChI

InChI=1S/C27H26N2O3S/c1-16-10-11-24(32-5)22(14-16)29-26(31)20-8-6-7-9-21(20)28-27(29)33-15-23(30)25-18(3)12-17(2)13-19(25)4/h6-14H,15H2,1-5H3