N-[1-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]benzimidazol-5-yl]cyclohexanecarboxamide

Systemtic Name: N-[1-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]benzimidazol-5-yl]cyclohexanecarboxamide Openeye Name: N-[1-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]benzimidazol-5-yl]cyclohexanecarboxamide CAS Name: N-[1-ethyl-2-[(4-methylsulfonyl-1-piperazinyl)methyl]-5-benzimidazolyl]cyclohexanecarboxamide IUPAC Name: N-[1-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]benzimidazol-5-yl]cyclohexanecarboxamide Traditional Name: N-[1-ethyl-2-[(4-mesylpiperazino)methyl]benzimidazol-5-yl]cyclohexanecarboxamide Formula: C22H33N5O3S MolecularWeight: 447.59412

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3CCCCC3)N=C1CN4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3CCCCC3)N=C1CN4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C22H33N5O3S/c1-3-27-20-10-9-18(23-22(28)17-7-5-4-6-8-17)15-19(20)24-21(27)16-25-11-13-26(14-12-25)31(2,29)30/h9-10,15,17H,3-8,11-14,16H2,1-2H3,(H,23,28)