N-[(2S)-4-cyclohexyl-1-[[(1S)-2-(5-fluoranyl-2,3-dihydroindol-1-yl)-1-phenyl-ethyl]amino]-1-oxidanylidene-butan-2-yl]-3-methoxy-benzamide

Systemtic Name: N-[(2S)-4-cyclohexyl-1-[[(1S)-2-(5-fluoranyl-2,3-dihydroindol-1-yl)-1-phenyl-ethyl]amino]-1-oxidanylidene-butan-2-yl]-3-methoxy-benzamide Openeye Name: N-[(1S)-3-cyclohexyl-1-[[(1S)-2-(5-fluoroindolin-1-yl)-1-phenyl-ethyl]carbamoyl]propyl]-3-methoxy-benzamide CAS Name: N-[(2S)-4-cyclohexyl-1-[[(1S)-2-(5-fluoro-2,3-dihydroindol-1-yl)-1-phenylethyl]amino]-1-oxobutan-2-yl]-3-methoxybenzamide IUPAC Name: N-[(2S)-4-cyclohexyl-1-[[(1S)-2-(5-fluoro-2,3-dihydroindol-1-yl)-1-phenylethyl]amino]-1-oxobutan-2-yl]-3-methoxybenzamide Traditional Name: N-[(1S)-3-cyclohexyl-1-[[(1S)-2-(5-fluoroindolin-1-yl)-1-phenyl-ethyl]carbamoyl]propyl]-3-methoxy-benzamide Formula: C34H40FN3O3 MolecularWeight: 557.698103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(CCC2CCCCC2)C(=O)NC(CN3CCC4=C3C=CC(=C4)F)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N[C@@H](CCC2CCCCC2)C(=O)N[C@H](CN3CCC4=C3C=CC(=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C34H40FN3O3/c1-41-29-14-8-13-27(22-29)33(39)36-30(17-15-24-9-4-2-5-10-24)34(40)37-31(25-11-6-3-7-12-25)23-38-20-19-26-21-28(35)16-18-32(26)38/h3,6-8,11-14,16,18,21-22,24,30-31H,2,4-5,9-10,15,17,19-20,23H2,1H3,(H,36,39)(H,37,40)/t30-,31+/m0/s1