ethyl 2-[5-[(5-ethoxycarbonyl-4-propanoyl-1H-benzimidazol-2-yl)carbonylsulfanyl]pentylsulfanylcarbonyl]-3-propanoyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-[5-[(5-ethoxycarbonyl-4-propanoyl-1H-benzimidazol-2-yl)carbonylsulfanyl]pentylsulfanylcarbonyl]-3-propanoyl-benzimidazole-5-carboxylate Openeye Name: ethyl 2-[5-(5-ethoxycarbonyl-4-propanoyl-1H-benzimidazole-2-carbonyl)sulfanylpentylsulfanylcarbonyl]-3-propanoyl-benzimidazole-5-carboxylate CAS Name: 2-[[5-[[[5-ethoxycarbonyl-4-(1-oxopropyl)-1H-benzimidazol-2-yl]-oxomethyl]thio]pentylthio]-oxomethyl]-3-(1-oxopropyl)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[5-(5-ethoxycarbonyl-4-propanoyl-1H-benzimidazole-2-carbonyl)sulfanylpentylsulfanylcarbonyl]-3-propanoylbenzimidazole-5-carboxylate Traditional Name: 2-[5-[(5-carbethoxy-4-propionyl-1H-benzimidazole-2-carbonyl)thio]pentylthio]carbonyl-3-propionyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C33H36N4O8S2 MolecularWeight: 680.79094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC2=C1N=C(N2)C(=O)SCCCCCSC(=O)C3=NC4=C(N3C(=O)CC)C=C(C=C4)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCC(=O)C1=C(C=CC2=C1N=C(N2)C(=O)SCCCCCSC(=O)C3=NC4=C(N3C(=O)CC)C=C(C=C4)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C33H36N4O8S2/c1-5-24(38)26-20(31(41)45-8-4)13-15-22-27(26)36-28(34-22)32(42)46-16-10-9-11-17-47-33(43)29-35-21-14-12-19(30(40)44-7-3)18-23(21)37(29)25(39)6-2/h12-15,18H,5-11,16-17H2,1-4H3,(H,34,36)