6-bromanyl-3-(2-methylpropyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-3-(2-methylpropyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 6-bromo-3-isobutyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 6-bromo-3-(2-methylpropyl)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 6-bromo-3-(2-methylpropyl)-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinazolin-4-one Traditional Name: 6-bromo-3-isobutyl-2-[(2-keto-2-piperidino-ethyl)thio]quinazolin-4-one Formula: C19H24BrN3O2S MolecularWeight: 438.38176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N3CCCCC3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N3CCCCC3

InChI

InChI=1S/C19H24BrN3O2S/c1-13(2)11-23-18(25)15-10-14(20)6-7-16(15)21-19(23)26-12-17(24)22-8-4-3-5-9-22/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3