(2S,4S,5R)-1-(4-tert-butyl-3-chloranyl-phenyl)carbonyl-2-(2-methylpropyl)-4-pyrazin-2-yl-5-pyridin-2-yl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4S,5R)-1-(4-tert-butyl-3-chloranyl-phenyl)carbonyl-2-(2-methylpropyl)-4-pyrazin-2-yl-5-pyridin-2-yl-pyrrolidine-2-carboxamide Openeye Name: (2S,4S,5R)-1-(4-tert-butyl-3-chloro-benzoyl)-2-isobutyl-4-pyrazin-2-yl-5-(2-pyridyl)pyrrolidine-2-carboxamide CAS Name: (2S,4S,5R)-1-[(4-tert-butyl-3-chlorophenyl)-oxomethyl]-2-(2-methylpropyl)-4-(2-pyrazinyl)-5-(2-pyridinyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S,4S,5R)-1-(4-tert-butyl-3-chlorobenzoyl)-2-(2-methylpropyl)-4-pyrazin-2-yl-5-pyridin-2-ylpyrrolidine-2-carboxamide Traditional Name: (2S,4S,5R)-1-(4-tert-butyl-3-chloro-benzoyl)-2-isobutyl-4-pyrazin-2-yl-5-(2-pyridyl)pyrrolidine-2-carboxamide Formula: C29H34ClN5O2 MolecularWeight: 520.06556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CC(C(N1C(=O)C2=CC(=C(C=C2)C(C)(C)C)Cl)C3=CC=CC=N3)C4=NC=CN=C4)C(=O)N

Isomeric SMILES

CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)C2=CC(=C(C=C2)C(C)(C)C)Cl)C3=CC=CC=N3)C4=NC=CN=C4)C(=O)N

InChI

InChI=1S/C29H34ClN5O2/c1-18(2)15-29(27(31)37)16-20(24-17-32-12-13-34-24)25(23-8-6-7-11-33-23)35(29)26(36)19-9-10-21(22(30)14-19)28(3,4)5/h6-14,17-18,20,25H,15-16H2,1-5H3,(H2,31,37)/t20-,25-,29+/m1/s1