N-[(2S)-1-[4-(2-tert-butyl-1-methyl-4,5-dihydroimidazol-4-yl)-2-fluoranyl-phenyl]-4-oxidanyl-butan-2-yl]-3-cyano-4-propan-2-yloxy-benzamide

Systemtic Name: N-[(2S)-1-[4-(2-tert-butyl-1-methyl-4,5-dihydroimidazol-4-yl)-2-fluoranyl-phenyl]-4-oxidanyl-butan-2-yl]-3-cyano-4-propan-2-yloxy-benzamide Openeye Name: N-[(1S)-1-[[4-(2-tert-butyl-1-methyl-4,5-dihydroimidazol-4-yl)-2-fluoro-phenyl]methyl]-3-hydroxy-propyl]-3-cyano-4-isopropoxy-benzamide CAS Name: N-[(2S)-1-[4-(2-tert-butyl-1-methyl-4,5-dihydroimidazol-4-yl)-2-fluorophenyl]-4-hydroxybutan-2-yl]-3-cyano-4-propan-2-yloxybenzamide IUPAC Name: N-[(2S)-1-[4-(2-tert-butyl-1-methyl-4,5-dihydroimidazol-4-yl)-2-fluorophenyl]-4-hydroxybutan-2-yl]-3-cyano-4-propan-2-yloxybenzamide Traditional Name: N-[(1S)-1-[4-(2-tert-butyl-1-methyl-2-imidazolin-4-yl)-2-fluoro-benzyl]-3-hydroxy-propyl]-3-cyano-4-isopropoxy-benzamide Formula: C29H37FN4O3 MolecularWeight: 508.627483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)NC(CCO)CC2=C(C=C(C=C2)C3CN(C(=N3)C(C)(C)C)C)F)C#N

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)N[C@H](CCO)CC2=C(C=C(C=C2)C3CN(C(=N3)C(C)(C)C)C)F)C#N

InChI

InChI=1S/C29H37FN4O3/c1-18(2)37-26-10-9-21(13-22(26)16-31)27(36)32-23(11-12-35)14-19-7-8-20(15-24(19)30)25-17-34(6)28(33-25)29(3,4)5/h7-10,13,15,18,23,25,35H,11-12,14,17H2,1-6H3,(H,32,36)/t23-,25?/m1/s1