2-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-3-ethyl-benzo[g]quinazolin-4-one

Systemtic Name: 2-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-3-ethyl-benzo[g]quinazolin-4-one Openeye Name: 2-[2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]sulfanyl-3-ethyl-benzo[g]quinazolin-4-one CAS Name: 2-[[2-(3,4-dihydroxyphenyl)-2-oxoethyl]thio]-3-ethyl-4-benzo[g]quinazolinone IUPAC Name: 2-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-3-ethylbenzo[g]quinazolin-4-one Traditional Name: 2-[[2-(3,4-dihydroxyphenyl)-2-keto-ethyl]thio]-3-ethyl-benzo[g]quinazolin-4-one Formula: C22H18N2O4S MolecularWeight: 406.45432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)C4=CC(=C(C=C4)O)O

Isomeric SMILES

CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)C4=CC(=C(C=C4)O)O

InChI

InChI=1S/C22H18N2O4S/c1-2-24-21(28)16-9-13-5-3-4-6-14(13)10-17(16)23-22(24)29-12-20(27)15-7-8-18(25)19(26)11-15/h3-11,25-26H,2,12H2,1H3