Methyl (2S)-3-(3-Carbamimidoylphenyl)-2-[[2-[(4-Methylphenyl)Sulfonylamino]Acetyl]Amino]Propanoate
[CAS# 133397-81-6]

Identification

• Name: Methyl (2S)-3-(3-Carbamimidoylphenyl)-2-[[2-[(4-Methylphenyl)Sulfonylamino]Acetyl]Amino]Propanoate
• Synonyms: (2S)-3-(3-Carbamimidoylphenyl)-2-[[2-[(4-Methylphenyl)Sulfonylamino]-1-Oxoethyl]Amino]Propanoic Acid Methyl Ester; (2S)-3-(3-Amidinophenyl)-2-[[2-[(4-Methylphenyl)Sulfonylamino]Acetyl]Amino]Propionic Acid Methyl Ester; Methyl (2S)-3-(3-Carbamimidoylphenyl)-2-[2-[(4-Methylphenyl)Sulfonylamino]Ethanoylamino]Propanoate
• Molecular Formula: C₂₀H₂₄N₄O₅S
• Molecular Weight: 432.49
• CAS Registry Number: 133397-81-6
• SMILES: [C@H](C(=O)OC)(NC(CN[S](=O)(=O)C1=CC=C(C=C1)C)=O)CC2=CC=CC(=C2)C(=N)N
• InChI: 1S/C20H24N4O5S/c1-13-6-8-16(9-7-13)30(27,28)23-12-18(25)24-17(20(26)29-2)11-14-4-3-5-15(10-14)19(21)22/h3-10,17,23H,11-12H2,1-2H3,(H3,21,22)(H,24,25)/t17-/m0/s1
• InChIKey: YAEIKQDHLCFGAA-KRWDZBQOSA-N

Properties

• Density: 1.352g/cm³ (Cal.)