butyl 2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylethanoate

Systemtic Name: butyl 2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylethanoate Openeye Name: butyl 2-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]acetic acid butyl ester Formula: C20H29N3O4S2 MolecularWeight: 439.59196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCCCOC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H29N3O4S2/c1-3-5-13-27-19(24)15-28-20-21-17-14-16(9-10-18(17)23(20)4-2)29(25,26)22-11-7-6-8-12-22/h9-10,14H,3-8,11-13,15H2,1-2H3