tert-butyl (3R)-5-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-yl-pyrrol-1-yl]-3-oxidanyl-pentanoate

Systemtic Name: tert-butyl (3R)-5-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-yl-pyrrol-1-yl]-3-oxidanyl-pentanoate Openeye Name: tert-butyl (3R)-5-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)pyrrol-1-yl]-3-hydroxy-pentanoate CAS Name: (3R)-5-[4-[anilino(oxo)methyl]-2-(4-fluorophenyl)-3-phenyl-5-propan-2-yl-1-pyrrolyl]-3-hydroxypentanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-5-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3-hydroxypentanoate Traditional Name: (3R)-5-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)pyrrol-1-yl]-3-hydroxy-valeric acid tert-butyl ester Formula: C35H39FN2O4 MolecularWeight: 570.693563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(N1CCC(CC(=O)OC(C)(C)C)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=C(C(=C(N1CC[C@H](CC(=O)OC(C)(C)C)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C35H39FN2O4/c1-23(2)32-31(34(41)37-27-14-10-7-11-15-27)30(24-12-8-6-9-13-24)33(25-16-18-26(36)19-17-25)38(32)21-20-28(39)22-29(40)42-35(3,4)5/h6-19,23,28,39H,20-22H2,1-5H3,(H,37,41)/t28-/m1/s1