[3-(1H-benzimidazol-2-ylsulfanyl)-2-(1H-benzimidazol-2-ylsulfanylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-yl]methyl 2-(dimethylamino)ethanoate

Systemtic Name: [3-(1H-benzimidazol-2-ylsulfanyl)-2-(1H-benzimidazol-2-ylsulfanylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-yl]methyl 2-(dimethylamino)ethanoate Openeye Name: [3-(1H-benzimidazol-2-ylsulfanyl)-2-(1H-benzimidazol-2-ylsulfanylmethyl)-4-hydroxy-5-oxo-2-furyl]methyl 2-(dimethylamino)acetate CAS Name: 2-(dimethylamino)acetic acid [3-(1H-benzimidazol-2-ylthio)-2-[(1H-benzimidazol-2-ylthio)methyl]-4-hydroxy-5-oxo-2-furanyl]methyl ester IUPAC Name: [3-(1H-benzimidazol-2-ylsulfanyl)-2-(1H-benzimidazol-2-ylsulfanylmethyl)-4-hydroxy-5-oxofuran-2-yl]methyl 2-(dimethylamino)acetate Traditional Name: 2-(dimethylamino)acetic acid [3-(1H-benzimidazol-2-ylthio)-2-[(1H-benzimidazol-2-ylthio)methyl]-4-hydroxy-5-keto-2-furyl]methyl ester Formula: C24H23N5O5S2 MolecularWeight: 525.59992

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(=O)OCC1(C(=C(C(=O)O1)O)SC2=NC3=CC=CC=C3N2)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CN(C)CC(=O)OCC1(C(=C(C(=O)O1)O)SC2=NC3=CC=CC=C3N2)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C24H23N5O5S2/c1-29(2)11-18(30)33-12-24(13-35-22-25-14-7-3-4-8-15(14)26-22)20(19(31)21(32)34-24)36-23-27-16-9-5-6-10-17(16)28-23/h3-10,31H,11-13H2,1-2H3,(H,25,26)(H,27,28)