ethyl 4-[3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H33N5O5S MolecularWeight: 491.60362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H33N5O5S/c1-3-33-23(30)27-15-13-26(14-16-27)22(29)10-9-21-24-19-17-18(7-8-20(19)25(21)2)34(31,32)28-11-5-4-6-12-28/h7-8,17H,3-6,9-16H2,1-2H3