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

Systemtic Name: 2-[2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-3-(3-phenylpropyl)quinazolin-4-one Openeye Name: 2-[2-(2,4-dihydroxyphenyl)-2-oxo-ethyl]sulfanyl-3-(3-phenylpropyl)quinazolin-4-one CAS Name: 2-[[2-(2,4-dihydroxyphenyl)-2-oxoethyl]thio]-3-(3-phenylpropyl)-4-quinazolinone IUPAC Name: 2-[2-(2,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-3-(3-phenylpropyl)quinazolin-4-one Traditional Name: 2-[[2-(2,4-dihydroxyphenyl)-2-keto-ethyl]thio]-3-(3-phenylpropyl)quinazolin-4-one Formula: C25H22N2O4S MolecularWeight: 446.51818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=C(C=C(C=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=C(C=C(C=C4)O)O

InChI

InChI=1S/C25H22N2O4S/c28-18-12-13-20(22(29)15-18)23(30)16-32-25-26-21-11-5-4-10-19(21)24(31)27(25)14-6-9-17-7-2-1-3-8-17/h1-5,7-8,10-13,15,28-29H,6,9,14,16H2