N-[(2S)-1-oxidanylidene-3-phenyl-1-[[(2S,3S)-5-phenyl-1-(phenylsulfonyl)-2-sulfanyl-pentan-3-yl]amino]propan-2-yl]morpholine-4-carboxamide

Systemtic Name: N-[(2S)-1-oxidanylidene-3-phenyl-1-[[(2S,3S)-5-phenyl-1-(phenylsulfonyl)-2-sulfanyl-pentan-3-yl]amino]propan-2-yl]morpholine-4-carboxamide Openeye Name: N-[(1S)-2-[[(1S,2S)-3-(benzenesulfonyl)-1-phenethyl-2-sulfanyl-propyl]amino]-1-benzyl-2-oxo-ethyl]morpholine-4-carboxamide CAS Name: N-[(2S)-1-[[(2S,3S)-1-(benzenesulfonyl)-2-mercapto-5-phenylpentan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-morpholinecarboxamide IUPAC Name: N-[(2S)-1-[[(2S,3S)-1-(benzenesulfonyl)-5-phenyl-2-sulfanylpentan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]morpholine-4-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-[[(1S,2S)-3-besyl-2-mercapto-1-phenethyl-propyl]amino]-2-keto-ethyl]morpholine-4-carboxamide Formula: C31H37N3O5S2 MolecularWeight: 595.77258

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CCC3=CC=CC=C3)C(CS(=O)(=O)C4=CC=CC=C4)S

Isomeric SMILES

C1COCCN1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCC3=CC=CC=C3)[C@@H](CS(=O)(=O)C4=CC=CC=C4)S

InChI

InChI=1S/C31H37N3O5S2/c35-30(28(22-25-12-6-2-7-13-25)33-31(36)34-18-20-39-21-19-34)32-27(17-16-24-10-4-1-5-11-24)29(40)23-41(37,38)26-14-8-3-9-15-26/h1-15,27-29,40H,16-23H2,(H,32,35)(H,33,36)/t27-,28-,29+/m0/s1