ethyl 4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylamino]benzoate

Systemtic Name: ethyl 4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methylamino]benzoate Openeye Name: ethyl 4-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methylamino]benzoate CAS Name: 4-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methylamino]benzoate Traditional Name: 4-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methylamino]benzoic acid ethyl ester Formula: C24H30N4O4S MolecularWeight: 470.5844

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CNC4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CNC4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C24H30N4O4S/c1-3-28-22-13-12-20(33(30,31)27-14-6-5-7-15-27)16-21(22)26-23(28)17-25-19-10-8-18(9-11-19)24(29)32-4-2/h8-13,16,25H,3-7,14-15,17H2,1-2H3