1,3-dihydropyrrolo[3,4-b]quinolin-2-yl-[4-(1,3-dithiolan-2-yl)-5-ethyl-furan-3-yl]methanone

Systemtic Name: 1,3-dihydropyrrolo[3,4-b]quinolin-2-yl-[4-(1,3-dithiolan-2-yl)-5-ethyl-furan-3-yl]methanone Openeye Name: 1,3-dihydropyrrolo[3,4-b]quinolin-2-yl-[4-(1,3-dithiolan-2-yl)-5-ethyl-3-furyl]methanone CAS Name: 1,3-dihydropyrrolo[3,4-b]quinolin-2-yl-[4-(1,3-dithiolan-2-yl)-5-ethyl-3-furanyl]methanone IUPAC Name: 1,3-dihydropyrrolo[3,4-b]quinolin-2-yl-[4-(1,3-dithiolan-2-yl)-5-ethylfuran-3-yl]methanone Traditional Name: 1,3-dihydropyrrolo[3,4-b]quinolin-2-yl-[4-(1,3-dithiolan-2-yl)-5-ethyl-3-furyl]methanone Formula: C21H20N2O2S2 MolecularWeight: 396.5257

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CO1)C(=O)N2CC3=CC4=CC=CC=C4N=C3C2)C5SCCS5

Isomeric SMILES

CCC1=C(C(=CO1)C(=O)N2CC3=CC4=CC=CC=C4N=C3C2)C5SCCS5

InChI

InChI=1S/C21H20N2O2S2/c1-2-18-19(21-26-7-8-27-21)15(12-25-18)20(24)23-10-14-9-13-5-3-4-6-16(13)22-17(14)11-23/h3-6,9,12,21H,2,7-8,10-11H2,1H3