3-(4-ethylphenyl)-2-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-ethylphenyl)-2-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(4-ethylphenyl)-2-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(4-ethylphenyl)-2-[[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(4-ethylphenyl)-2-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]sulfanylquinazolin-4-one Traditional Name: 3-(4-ethylphenyl)-2-[[2-keto-2-(3,4,5-trimethoxyphenyl)ethyl]thio]quinazolin-4-one Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C27H26N2O5S/c1-5-17-10-12-19(13-11-17)29-26(31)20-8-6-7-9-21(20)28-27(29)35-16-22(30)18-14-23(32-2)25(34-4)24(15-18)33-3/h6-15H,5,16H2,1-4H3