N-[1-(2,2-dimethylpropanoyl)-2,3-dihydroindol-6-yl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(2,2-dimethylpropanoyl)-2,3-dihydroindol-6-yl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(2,2-dimethylpropanoyl)indolin-6-yl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(2,2-dimethyl-1-oxopropyl)-2,3-dihydroindol-6-yl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(2,2-dimethylpropanoyl)-2,3-dihydroindol-6-yl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: 1-mesyl-N-(1-pivaloylindolin-6-yl)isonipecotamide Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCC2=C1C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C(=O)N1CCC2=C1C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C20H29N3O4S/c1-20(2,3)19(25)23-12-9-14-5-6-16(13-17(14)23)21-18(24)15-7-10-22(11-8-15)28(4,26)27/h5-6,13,15H,7-12H2,1-4H3,(H,21,24)