2-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(1-phenylethyl)quinazolin-4-one

Systemtic Name: 2-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(1-phenylethyl)quinazolin-4-one Openeye Name: 2-[2-(5-bromo-2-thienyl)-2-oxo-ethyl]sulfanyl-3-(1-phenylethyl)quinazolin-4-one CAS Name: 2-[[2-(5-bromo-2-thiophenyl)-2-oxoethyl]thio]-3-(1-phenylethyl)-4-quinazolinone IUPAC Name: 2-[2-(5-bromothiophen-2-yl)-2-oxoethyl]sulfanyl-3-(1-phenylethyl)quinazolin-4-one Traditional Name: 2-[[2-(5-bromo-2-thienyl)-2-keto-ethyl]thio]-3-(1-phenylethyl)quinazolin-4-one Formula: C22H17BrN2O2S2 MolecularWeight: 485.41658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(S4)Br

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C22H17BrN2O2S2/c1-14(15-7-3-2-4-8-15)25-21(27)16-9-5-6-10-17(16)24-22(25)28-13-18(26)19-11-12-20(23)29-19/h2-12,14H,13H2,1H3