N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-1-mesyl-isonipecotamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(CNC(=O)C2CCN(CC2)S(=O)(=O)C)C3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC(=C1OC)C(CNC(=O)C2CCN(CC2)S(=O)(=O)C)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H31N3O5S/c1-32-23-10-6-8-19(24(23)33-2)21(20-15-26-22-9-5-4-7-18(20)22)16-27-25(29)17-11-13-28(14-12-17)34(3,30)31/h4-10,15,17,21,26H,11-14,16H2,1-3H3,(H,27,29)