(2R)-2-azanyl-N-[(2S)-1-[[(2S)-6-azanyl-1-oxidanylidene-hexan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-6-[(4-methylphenyl)sulfonylamino]hexanamide

Systemtic Name: (2R)-2-azanyl-N-[(2S)-1-[[(2S)-6-azanyl-1-oxidanylidene-hexan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-6-[(4-methylphenyl)sulfonylamino]hexanamide Openeye Name: (2R)-2-amino-N-[(1S)-2-[[(1S)-5-amino-1-formyl-pentyl]amino]-1-benzyl-2-oxo-ethyl]-6-(p-tolylsulfonylamino)hexanamide CAS Name: (2R)-2-amino-N-[(2S)-1-[[(2S)-6-amino-1-oxohexan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-6-[(4-methylphenyl)sulfonylamino]hexanamide IUPAC Name: (2R)-2-amino-N-[(2S)-1-[[(2S)-6-amino-1-oxohexan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-6-[(4-methylphenyl)sulfonylamino]hexanamide Traditional Name: (2R)-2-amino-N-[(1S)-2-[[(1S)-5-amino-1-formyl-pentyl]amino]-1-benzyl-2-keto-ethyl]-6-(tosylamino)hexanamide Formula: C28H41N5O5S MolecularWeight: 559.72064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCCC(C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CCCCN)C=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCC[C@H](C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCCCN)C=O)N

InChI

InChI=1S/C28H41N5O5S/c1-21-13-15-24(16-14-21)39(37,38)31-18-8-6-12-25(30)27(35)33-26(19-22-9-3-2-4-10-22)28(36)32-23(20-34)11-5-7-17-29/h2-4,9-10,13-16,20,23,25-26,31H,5-8,11-12,17-19,29-30H2,1H3,(H,32,36)(H,33,35)/t23-,25+,26-/m0/s1