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

Systemtic Name: 2-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[2-(5-bromo-2-thienyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 2-[[2-(5-bromo-2-thiophenyl)-2-oxoethyl]thio]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[2-(5-bromothiophen-2-yl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-benzyl-2-[[2-(5-bromo-2-thienyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C21H15BrN2O2S2 MolecularWeight: 471.39

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(S4)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C21H15BrN2O2S2/c22-19-11-10-18(28-19)17(25)13-27-21-23-16-9-5-4-8-15(16)20(26)24(21)12-14-6-2-1-3-7-14/h1-11H,12-13H2