ethanedioic acid; 2-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]ethanol

Systemtic Name: ethanedioic acid; 2-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]ethanol Openeye Name: oxalic acid; 2-[4-[2-(2-thienyl)quinazolin-4-yl]piperazin-1-yl]ethanol CAS Name: oxalic acid; 2-[4-(2-thiophen-2-yl-4-quinazolinyl)-1-piperazinyl]ethanol IUPAC Name: oxalic acid; 2-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]ethanol Traditional Name: oxalic acid; 2-[4-[2-(2-thienyl)quinazolin-4-yl]piperazino]ethanol Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CCO)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H20N4OS.C2H2O4/c23-12-11-21-7-9-22(10-8-21)18-14-4-1-2-5-15(14)19-17(20-18)16-6-3-13-24-16;3-1(4)2(5)6/h1-6,13,23H,7-12H2;(H,3,4)(H,5,6)