N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxidanylidene-5-phenacylsulfanyl-2H-imidazo[1,2-c]quinazolin-2-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxidanylidene-5-phenacylsulfanyl-2H-imidazo[1,2-c]quinazolin-2-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxo-5-phenacylsulfanyl-2H-imidazo[1,2-c]quinazolin-2-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-oxo-5-(phenacylthio)-2H-imidazo[1,2-c]quinazolin-2-yl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxo-5-phenacylsulfanyl-2H-imidazo[1,2-c]quinazolin-2-yl)acetamide Traditional Name: 2-[3-keto-5-(phenacylthio)-2H-imidazo[1,2-c]quinazolin-2-yl]-N-piperonyl-acetamide Formula: C28H22N4O5S MolecularWeight: 526.56308

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3C(=O)N4C(=N3)C5=CC=CC=C5N=C4SCC(=O)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3C(=O)N4C(=N3)C5=CC=CC=C5N=C4SCC(=O)C6=CC=CC=C6

InChI

InChI=1S/C28H22N4O5S/c33-22(18-6-2-1-3-7-18)15-38-28-31-20-9-5-4-8-19(20)26-30-21(27(35)32(26)28)13-25(34)29-14-17-10-11-23-24(12-17)37-16-36-23/h1-12,21H,13-16H2,(H,29,34)