methyl 4-[4-[3-(2-methylsulfanylethyl)-2-oxidanylidene-benzimidazol-1-yl]piperidin-1-yl]piperidine-1-carboxylate

Systemtic Name: methyl 4-[4-[3-(2-methylsulfanylethyl)-2-oxidanylidene-benzimidazol-1-yl]piperidin-1-yl]piperidine-1-carboxylate Openeye Name: methyl 4-[4-[3-(2-methylsulfanylethyl)-2-oxo-benzimidazol-1-yl]-1-piperidyl]piperidine-1-carboxylate CAS Name: 4-[4-[3-[2-(methylthio)ethyl]-2-oxo-1-benzimidazolyl]-1-piperidinyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-[3-(2-methylsulfanylethyl)-2-oxobenzimidazol-1-yl]piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[2-keto-3-[2-(methylthio)ethyl]benzimidazol-1-yl]piperidino]piperidine-1-carboxylic acid methyl ester Formula: C22H32N4O3S MolecularWeight: 432.57948

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(CC1)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)CCSC

Isomeric SMILES

COC(=O)N1CCC(CC1)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)CCSC

InChI

InChI=1S/C22H32N4O3S/c1-29-22(28)24-13-7-17(8-14-24)23-11-9-18(10-12-23)26-20-6-4-3-5-19(20)25(21(26)27)15-16-30-2/h3-6,17-18H,7-16H2,1-2H3