1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-ethanone Openeye Name: 1-[4-(furan-2-carbonyl)piperazin-1-yl]-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-ethanone CAS Name: 1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-[[4-(methylamino)-2-quinazolinyl]thio]ethanone IUPAC Name: 1-[4-(furan-2-carbonyl)piperazin-1-yl]-2-[4-(methylamino)quinazolin-2-yl]sulfanylethanone Traditional Name: 1-[4-(2-furoyl)piperazino]-2-[[4-(methylamino)quinazolin-2-yl]thio]ethanone Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=CC=CC=C21)SCC(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CNC1=NC(=NC2=CC=CC=C21)SCC(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C20H21N5O3S/c1-21-18-14-5-2-3-6-15(14)22-20(23-18)29-13-17(26)24-8-10-25(11-9-24)19(27)16-7-4-12-28-16/h2-7,12H,8-11,13H2,1H3,(H,21,22,23)