N-(1,3-benzodioxol-5-ylmethyl)-2-[3-oxidanylidene-5-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-2H-imidazo[1,2-c]quinazolin-2-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-oxidanylidene-5-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-2H-imidazo[1,2-c]quinazolin-2-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-oxo-5-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-2H-imidazo[1,2-c]quinazolin-2-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-oxo-5-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-2H-imidazo[1,2-c]quinazolin-2-yl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-oxo-5-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-2H-imidazo[1,2-c]quinazolin-2-yl]acetamide Traditional Name: 2-[3-keto-5-[(4-ketopyrido[1,2-a]pyrimidin-2-yl)methylthio]-2H-imidazo[1,2-c]quinazolin-2-yl]-N-piperonyl-acetamide Formula: C29H22N6O5S MolecularWeight: 566.58718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3C(=O)N4C(=N3)C5=CC=CC=C5N=C4SCC6=CC(=O)N7C=CC=CC7=N6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3C(=O)N4C(=N3)C5=CC=CC=C5N=C4SCC6=CC(=O)N7C=CC=CC7=N6

InChI

InChI=1S/C29H22N6O5S/c36-25(30-14-17-8-9-22-23(11-17)40-16-39-22)13-21-28(38)35-27(32-21)19-5-1-2-6-20(19)33-29(35)41-15-18-12-26(37)34-10-4-3-7-24(34)31-18/h1-12,21H,13-16H2,(H,30,36)