methyl 2-[2-(2,2,6,6-tetramethylpiperidin-1-yl)ethylsulfanyl]-3H-benzimidazole-5-carboxylate

Systemtic Name: methyl 2-[2-(2,2,6,6-tetramethylpiperidin-1-yl)ethylsulfanyl]-3H-benzimidazole-5-carboxylate Openeye Name: methyl 2-[2-(2,2,6,6-tetramethyl-1-piperidyl)ethylsulfanyl]-3H-benzimidazole-5-carboxylate CAS Name: 2-[2-(2,2,6,6-tetramethyl-1-piperidinyl)ethylthio]-3H-benzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2,2,6,6-tetramethylpiperidin-1-yl)ethylsulfanyl]-3H-benzimidazole-5-carboxylate Traditional Name: 2-[2-(2,2,6,6-tetramethylpiperidino)ethylthio]-3H-benzimidazole-5-carboxylic acid methyl ester Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(N1CCSC2=NC3=C(N2)C=C(C=C3)C(=O)OC)(C)C)C

Isomeric SMILES

CC1(CCCC(N1CCSC2=NC3=C(N2)C=C(C=C3)C(=O)OC)(C)C)C

InChI

InChI=1S/C20H29N3O2S/c1-19(2)9-6-10-20(3,4)23(19)11-12-26-18-21-15-8-7-14(17(24)25-5)13-16(15)22-18/h7-8,13H,6,9-12H2,1-5H3,(H,21,22)