(2S,3S)-3-[[(2S)-1-oxidanylidene-4-phenyl-1-(pyridin-4-ylmethylamino)butan-2-yl]carbamoyl]oxirane-2-carboxylic acid

Systemtic Name: (2S,3S)-3-[[(2S)-1-oxidanylidene-4-phenyl-1-(pyridin-4-ylmethylamino)butan-2-yl]carbamoyl]oxirane-2-carboxylic acid Openeye Name: (2S,3S)-3-[[(1S)-3-phenyl-1-(4-pyridylmethylcarbamoyl)propyl]carbamoyl]oxirane-2-carboxylic acid CAS Name: (2S,3S)-3-[oxo-[[(2S)-1-oxo-4-phenyl-1-(pyridin-4-ylmethylamino)butan-2-yl]amino]methyl]-2-oxiranecarboxylic acid IUPAC Name: (2S,3S)-3-[[(2S)-1-oxo-4-phenyl-1-(pyridin-4-ylmethylamino)butan-2-yl]carbamoyl]oxirane-2-carboxylic acid Traditional Name: (2S,3S)-3-[[(1S)-3-phenyl-1-(4-pyridylmethylcarbamoyl)propyl]carbamoyl]oxirane-2-carboxylic acid Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)NCC2=CC=NC=C2)NC(=O)C3C(O3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC[C@@H](C(=O)NCC2=CC=NC=C2)NC(=O)[C@@H]3[C@H](O3)C(=O)O

InChI

InChI=1S/C20H21N3O5/c24-18(22-12-14-8-10-21-11-9-14)15(7-6-13-4-2-1-3-5-13)23-19(25)16-17(28-16)20(26)27/h1-5,8-11,15-17H,6-7,12H2,(H,22,24)(H,23,25)(H,26,27)/t15-,16-,17-/m0/s1