1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanone Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-ethanone CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-[[2-(2-furanyl)-4-quinazolinyl]thio]ethanone IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylethanone Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)piperidino]-2-[[2-(2-furyl)quinazolin-4-yl]thio]ethanone Formula: C26H22N4O2S2 MolecularWeight: 486.60848

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C26H22N4O2S2/c31-23(30-13-5-7-17(15-30)25-28-20-10-3-4-12-22(20)34-25)16-33-26-18-8-1-2-9-19(18)27-24(29-26)21-11-6-14-32-21/h1-4,6,8-12,14,17H,5,7,13,15-16H2