1,3-benzodioxol-5-yl-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-[2-(2-thienyl)quinazolin-4-yl]piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-(2-thiophen-2-yl-4-quinazolinyl)-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-[2-(2-thienyl)quinazolin-4-yl]piperazino]methanone Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NC3=CC=CC=C32)C4=CC=CS4)C(=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN(CCN1C2=NC(=NC3=CC=CC=C32)C4=CC=CS4)C(=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C24H20N4O3S/c29-24(16-7-8-19-20(14-16)31-15-30-19)28-11-9-27(10-12-28)23-17-4-1-2-5-18(17)25-22(26-23)21-6-3-13-32-21/h1-8,13-14H,9-12,15H2