N-[(1-ethylbenzimidazol-2-yl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(1-ethyl-2-benzimidazolyl)methyl]-1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C23H27N5O5S MolecularWeight: 485.55598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1CNC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])C

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1CNC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])C

InChI

InChI=1S/C23H27N5O5S/c1-3-27-20-7-5-4-6-19(20)25-22(27)15-24-23(29)17-10-12-26(13-11-17)34(32,33)21-14-18(28(30)31)9-8-16(21)2/h4-9,14,17H,3,10-13,15H2,1-2H3,(H,24,29)