N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]azepane-1-carbothioamide

Systemtic Name: N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]azepane-1-carbothioamide Openeye Name: N-[2,3-bis(2-furyl)quinoxalin-6-yl]azepane-1-carbothioamide CAS Name: N-[2,3-bis(2-furanyl)-6-quinoxalinyl]-1-azepanecarbothioamide IUPAC Name: N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]azepane-1-carbothioamide Traditional Name: N-[2,3-bis(2-furyl)quinoxalin-6-yl]azepane-1-carbothioamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CO4)C5=CC=CO5

Isomeric SMILES

C1CCCN(CC1)C(=S)NC2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CO4)C5=CC=CO5

InChI

InChI=1S/C23H22N4O2S/c30-23(27-11-3-1-2-4-12-27)24-16-9-10-17-18(15-16)26-22(20-8-6-14-29-20)21(25-17)19-7-5-13-28-19/h5-10,13-15H,1-4,11-12H2,(H,24,30)