(2R,4S,5R)-1-(4-tert-butylphenyl)carbonyl-2-(phenylmethyl)-4-pyrazin-2-yl-5-pyridin-3-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,4S,5R)-1-(4-tert-butylphenyl)carbonyl-2-(phenylmethyl)-4-pyrazin-2-yl-5-pyridin-3-yl-pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S,5R)-2-benzyl-1-(4-tert-butylbenzoyl)-4-pyrazin-2-yl-5-(3-pyridyl)pyrrolidine-2-carboxylic acid CAS Name: (2R,4S,5R)-1-[(4-tert-butylphenyl)-oxomethyl]-2-(phenylmethyl)-4-(2-pyrazinyl)-5-(3-pyridinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S,5R)-2-benzyl-1-(4-tert-butylbenzoyl)-4-pyrazin-2-yl-5-pyridin-3-ylpyrrolidine-2-carboxylic acid Traditional Name: (2R,4S,5R)-2-benzyl-1-(4-tert-butylbenzoyl)-4-pyrazin-2-yl-5-(3-pyridyl)proline Formula: C32H32N4O3 MolecularWeight: 520.62148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(C(CC2(CC3=CC=CC=C3)C(=O)O)C4=NC=CN=C4)C5=CN=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2[C@H]([C@H](C[C@@]2(CC3=CC=CC=C3)C(=O)O)C4=NC=CN=C4)C5=CN=CC=C5

InChI

InChI=1S/C32H32N4O3/c1-31(2,3)25-13-11-23(12-14-25)29(37)36-28(24-10-7-15-33-20-24)26(27-21-34-16-17-35-27)19-32(36,30(38)39)18-22-8-5-4-6-9-22/h4-17,20-21,26,28H,18-19H2,1-3H3,(H,38,39)/t26-,28+,32+/m1/s1