N-[(2S)-1-[2-(5-cyano-2,3-dihydroindol-1-yl)ethylamino]-4-cyclohexyl-1-oxidanylidene-butan-2-yl]-3-methoxy-benzamide

Systemtic Name: N-[(2S)-1-[2-(5-cyano-2,3-dihydroindol-1-yl)ethylamino]-4-cyclohexyl-1-oxidanylidene-butan-2-yl]-3-methoxy-benzamide Openeye Name: N-[(1S)-1-[2-(5-cyanoindolin-1-yl)ethylcarbamoyl]-3-cyclohexyl-propyl]-3-methoxy-benzamide CAS Name: N-[(2S)-1-[2-(5-cyano-2,3-dihydroindol-1-yl)ethylamino]-4-cyclohexyl-1-oxobutan-2-yl]-3-methoxybenzamide IUPAC Name: N-[(2S)-1-[2-(5-cyano-2,3-dihydroindol-1-yl)ethylamino]-4-cyclohexyl-1-oxobutan-2-yl]-3-methoxybenzamide Traditional Name: N-[(1S)-1-[2-(5-cyanoindolin-1-yl)ethylcarbamoyl]-3-cyclohexyl-propyl]-3-methoxy-benzamide Formula: C29H36N4O3 MolecularWeight: 488.62114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(CCC2CCCCC2)C(=O)NCCN3CCC4=C3C=CC(=C4)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N[C@@H](CCC2CCCCC2)C(=O)NCCN3CCC4=C3C=CC(=C4)C#N

InChI

InChI=1S/C29H36N4O3/c1-36-25-9-5-8-24(19-25)28(34)32-26(12-10-21-6-3-2-4-7-21)29(35)31-15-17-33-16-14-23-18-22(20-30)11-13-27(23)33/h5,8-9,11,13,18-19,21,26H,2-4,6-7,10,12,14-17H2,1H3,(H,31,35)(H,32,34)/t26-/m0/s1