butyl 2-(1-cyclopentyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylpropanoate

Systemtic Name: butyl 2-(1-cyclopentyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylpropanoate Openeye Name: butyl 2-(1-cyclopentyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylpropanoate CAS Name: 2-[[1-cyclopentyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]thio]propanoic acid butyl ester IUPAC Name: butyl 2-(1-cyclopentyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)sulfanylpropanoate Traditional Name: 2-[(1-cyclopentyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)thio]propionic acid butyl ester Formula: C23H33N3O4S2 MolecularWeight: 479.65582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)SC1=NC2=C(N1C3CCCC3)C=CC(=C2)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCCCOC(=O)C(C)SC1=NC2=C(N1C3CCCC3)C=CC(=C2)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H33N3O4S2/c1-3-4-15-30-22(27)17(2)31-23-24-20-16-19(32(28,29)25-13-7-8-14-25)11-12-21(20)26(23)18-9-5-6-10-18/h11-12,16-18H,3-10,13-15H2,1-2H3