2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-[2-(2-thienyl)quinazolin-4-yl]piperazin-1-yl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-thiophen-2-yl-4-quinazolinyl)-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-[2-(2-thienyl)quinazolin-4-yl]piperazino]methanone Formula: C25H22N4O3S MolecularWeight: 458.53218

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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)OCCO6

Isomeric SMILES

C1CN(CCN1C2=NC(=NC3=CC=CC=C32)C4=CC=CS4)C(=O)C5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C25H22N4O3S/c30-25(17-7-8-20-21(16-17)32-14-13-31-20)29-11-9-28(10-12-29)24-18-4-1-2-5-19(18)26-23(27-24)22-6-3-15-33-22/h1-8,15-16H,9-14H2