[4-[4-[(3,5-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]phenyl]carbonylphenyl] ethanoate

Systemtic Name: [4-[4-[(3,5-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]phenyl]carbonylphenyl] ethanoate Openeye Name: [4-[4-[(3,5-dimethyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]benzoyl]phenyl] acetate CAS Name: acetic acid [4-[[4-[[(3,5-dimethyl-4-oxo-2-quinazolinyl)thio]methyl]phenyl]-oxomethyl]phenyl] ester IUPAC Name: [4-[4-[(3,5-dimethyl-4-oxoquinazolin-2-yl)sulfanylmethyl]benzoyl]phenyl] acetate Traditional Name: acetic acid [4-[4-[[(4-keto-3,5-dimethyl-quinazolin-2-yl)thio]methyl]benzoyl]phenyl] ester Formula: C26H22N2O4S MolecularWeight: 458.52888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)OC(=O)C

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)OC(=O)C

InChI

InChI=1S/C26H22N2O4S/c1-16-5-4-6-22-23(16)25(31)28(3)26(27-22)33-15-18-7-9-19(10-8-18)24(30)20-11-13-21(14-12-20)32-17(2)29/h4-14H,15H2,1-3H3