6-bromanyl-3-(2-methylpropyl)-2-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-(2-methylpropyl)-2-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 6-bromo-3-isobutyl-2-[[2-(2-pyridyl)thiazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 6-bromo-3-(2-methylpropyl)-2-[[2-(2-pyridinyl)-4-thiazolyl]methylthio]-4-quinazolinone IUPAC Name: 6-bromo-3-(2-methylpropyl)-2-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 6-bromo-3-isobutyl-2-[[2-(2-pyridyl)thiazol-4-yl]methylthio]quinazolin-4-one Formula: C21H19BrN4OS2 MolecularWeight: 487.43576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3=CSC(=N3)C4=CC=CC=N4

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3=CSC(=N3)C4=CC=CC=N4

InChI

InChI=1S/C21H19BrN4OS2/c1-13(2)10-26-20(27)16-9-14(22)6-7-17(16)25-21(26)29-12-15-11-28-19(24-15)18-5-3-4-8-23-18/h3-9,11,13H,10,12H2,1-2H3