S-[5-[(5,6-dimethyl-1H-benzimidazol-2-yl)carbonylsulfanyl]pentyl] 5,6-dimethyl-1H-benzimidazole-2-carbothioate

Systemtic Name: S-[5-[(5,6-dimethyl-1H-benzimidazol-2-yl)carbonylsulfanyl]pentyl] 5,6-dimethyl-1H-benzimidazole-2-carbothioate Openeye Name: S-[5-(5,6-dimethyl-1H-benzimidazole-2-carbonyl)sulfanylpentyl] 5,6-dimethyl-1H-benzimidazole-2-carbothioate CAS Name: 5,6-dimethyl-1H-benzimidazole-2-carbothioic acid S-[5-[[(5,6-dimethyl-1H-benzimidazol-2-yl)-oxomethyl]thio]pentyl] ester IUPAC Name: S-[5-(5,6-dimethyl-1H-benzimidazole-2-carbonyl)sulfanylpentyl] 5,6-dimethyl-1H-benzimidazole-2-carbothioate Traditional Name: 5,6-dimethyl-1H-benzimidazole-2-carbothioic acid S-[5-[(5,6-dimethyl-1H-benzimidazole-2-carbonyl)thio]pentyl] ester Formula: C25H28N4O2S2 MolecularWeight: 480.64542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C(=O)SCCCCCSC(=O)C3=NC4=C(N3)C=C(C(=C4)C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C(=O)SCCCCCSC(=O)C3=NC4=C(N3)C=C(C(=C4)C)C

InChI

InChI=1S/C25H28N4O2S2/c1-14-10-18-19(11-15(14)2)27-22(26-18)24(30)32-8-6-5-7-9-33-25(31)23-28-20-12-16(3)17(4)13-21(20)29-23/h10-13H,5-9H2,1-4H3,(H,26,27)(H,28,29)