(4-aminophenyl)sulfonyl-[(2S)-6-azanyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl]-(2-methylpropyl)-(4-phenylbutanoyl)azanium

Systemtic Name: (4-aminophenyl)sulfonyl-[(2S)-6-azanyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl]-(2-methylpropyl)-(4-phenylbutanoyl)azanium Openeye Name: [(1S)-5-amino-1-carboxy-pentyl]-(4-aminophenyl)sulfonyl-isobutyl-(4-phenylbutanoyl)ammonium CAS Name: [(2S)-6-amino-1-hydroxy-1-oxohexan-2-yl]-(4-aminophenyl)sulfonyl-(2-methylpropyl)-(1-oxo-4-phenylbutyl)ammonium IUPAC Name: [(2S)-6-amino-1-hydroxy-1-oxohexan-2-yl]-(4-aminophenyl)sulfonyl-(2-methylpropyl)-(4-phenylbutanoyl)azanium Traditional Name: [(1S)-5-amino-1-carboxy-pentyl]-isobutyl-(4-phenylbutanoyl)-sulfanilyl-ammonium Formula: C26H38N3O5S+ MolecularWeight: 504.66202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+](C(CCCCN)C(=O)O)(C(=O)CCCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)N

Isomeric SMILES

CC(C)C[N+]([C@@H](CCCCN)C(=O)O)(C(=O)CCCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C26H37N3O5S/c1-20(2)19-29(24(26(31)32)12-6-7-18-27,35(33,34)23-16-14-22(28)15-17-23)25(30)13-8-11-21-9-4-3-5-10-21/h3-5,9-10,14-17,20,24H,6-8,11-13,18-19,27-28H2,1-2H3/p+1/t24-,29?/m0/s1