1-pyrrolidin-1-yl-2-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]ethanone

Systemtic Name: 1-pyrrolidin-1-yl-2-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]ethanone Openeye Name: 1-pyrrolidin-1-yl-2-[4-[2-(2-thienyl)quinazolin-4-yl]piperazin-1-yl]ethanone CAS Name: 1-(1-pyrrolidinyl)-2-[4-(2-thiophen-2-yl-4-quinazolinyl)-1-piperazinyl]ethanone IUPAC Name: 1-pyrrolidin-1-yl-2-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]ethanone Traditional Name: 1-pyrrolidino-2-[4-[2-(2-thienyl)quinazolin-4-yl]piperazino]ethanone Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C22H25N5OS/c28-20(26-9-3-4-10-26)16-25-11-13-27(14-12-25)22-17-6-1-2-7-18(17)23-21(24-22)19-8-5-15-29-19/h1-2,5-8,15H,3-4,9-14,16H2