N-[(2S)-3-cyclohexyl-1-[2-(5-fluoranyl-2,3-dihydroindol-1-yl)ethylamino]-1-oxidanylidene-propan-2-yl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2S)-3-cyclohexyl-1-[2-(5-fluoranyl-2,3-dihydroindol-1-yl)ethylamino]-1-oxidanylidene-propan-2-yl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-1-(cyclohexylmethyl)-2-[2-(5-fluoroindolin-1-yl)ethylamino]-2-oxo-ethyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[(2S)-3-cyclohexyl-1-[2-(5-fluoro-2,3-dihydroindol-1-yl)ethylamino]-1-oxopropan-2-yl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2S)-3-cyclohexyl-1-[2-(5-fluoro-2,3-dihydroindol-1-yl)ethylamino]-1-oxopropan-2-yl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[(1S)-1-(cyclohexylmethyl)-2-[2-(5-fluoroindolin-1-yl)ethylamino]-2-keto-ethyl]-1-mesyl-isonipecotamide Formula: C26H39FN4O4S MolecularWeight: 522.675663

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC(CC2CCCCC2)C(=O)NCCN3CCC4=C3C=CC(=C4)F

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)N[C@@H](CC2CCCCC2)C(=O)NCCN3CCC4=C3C=CC(=C4)F

InChI

InChI=1S/C26H39FN4O4S/c1-36(34,35)31-14-10-20(11-15-31)25(32)29-23(17-19-5-3-2-4-6-19)26(33)28-12-16-30-13-9-21-18-22(27)7-8-24(21)30/h7-8,18-20,23H,2-6,9-17H2,1H3,(H,28,33)(H,29,32)/t23-/m0/s1