(2S)-1-(2-pyridin-4-ylethanoyl)-N-[4-[(E)-2-[4-[[(2S)-1-(2-pyridin-4-ylethanoyl)pyrrolidin-2-yl]carbonylamino]phenyl]ethenyl]phenyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(2-pyridin-4-ylethanoyl)-N-[4-[(E)-2-[4-[[(2S)-1-(2-pyridin-4-ylethanoyl)pyrrolidin-2-yl]carbonylamino]phenyl]ethenyl]phenyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[2-(4-pyridyl)acetyl]-N-[4-[(E)-2-[4-[[(2S)-1-[2-(4-pyridyl)acetyl]pyrrolidine-2-carbonyl]amino]phenyl]vinyl]phenyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[4-[(E)-2-[4-[[oxo-[(2S)-1-(1-oxo-2-pyridin-4-ylethyl)-2-pyrrolidinyl]methyl]amino]phenyl]ethenyl]phenyl]-1-(1-oxo-2-pyridin-4-ylethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(2-pyridin-4-ylacetyl)-N-[4-[(E)-2-[4-[[(2S)-1-(2-pyridin-4-ylacetyl)pyrrolidine-2-carbonyl]amino]phenyl]ethenyl]phenyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[2-(4-pyridyl)acetyl]-N-[4-[(E)-2-[4-[[(2S)-1-[2-(4-pyridyl)acetyl]prolyl]amino]phenyl]vinyl]phenyl]pyrrolidine-2-carboxamide Formula: C38H38N6O4 MolecularWeight: 642.74612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC2=CC=NC=C2)C(=O)NC3=CC=C(C=C3)C=CC4=CC=C(C=C4)NC(=O)C5CCCN5C(=O)CC6=CC=NC=C6

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CC2=CC=NC=C2)C(=O)NC3=CC=C(C=C3)/C=C/C4=CC=C(C=C4)NC(=O)[C@@H]5CCCN5C(=O)CC6=CC=NC=C6

InChI

InChI=1S/C38H38N6O4/c45-35(25-29-15-19-39-20-16-29)43-23-1-3-33(43)37(47)41-31-11-7-27(8-12-31)5-6-28-9-13-32(14-10-28)42-38(48)34-4-2-24-44(34)36(46)26-30-17-21-40-22-18-30/h5-22,33-34H,1-4,23-26H2,(H,41,47)(H,42,48)/b6-5+/t33-,34-/m0/s1