Dimethyl 5-[[(2S)-6-Amino-2-Phenylmethoxycarbonylaminohexanethioyl]Amino]Benzene-1,3-Dicarboxylate Hydrochloride
[CAS# 111070-39-4]

Identification

• Name: Dimethyl 5-[[(2S)-6-Amino-2-Phenylmethoxycarbonylaminohexanethioyl]Amino]Benzene-1,3-Dicarboxylate Hydrochloride
• Synonyms: Dimethyl 5-[[(2S)-6-Amino-2-Benzyloxycarbonylamino-Hexanethioyl]Amino]Benzene-1,3-Dicarboxylate Hydrochloride; 5-[[(2S)-6-Amino-2-Benzyloxycarbonylamino-1-Thioxohexyl]Amino]Benzene-1,3-Dicarboxylic Acid Dimethyl Ester Hydrochloride; 5-[[(2S)-6-Amino-2-Benzyloxycarbonylamino-Hexanethioyl]Amino]Benzene-1,3-Dicarboxylic Acid Dimethyl Ester Hydrochloride
• Molecular Formula: C₂₄H₃₀ClN₃O₆S
• Molecular Weight: 524.03
• CAS Registry Number: 111070-39-4
• SMILES: [C@@H](NC(OCC1=CC=CC=C1)=O)(C(=S)NC2=CC(=CC(=C2)C(OC)=O)C(OC)=O)CCCCN.[H+].[Cl-]
• InChI: 1S/C24H29N3O6S.ClH/c1-31-22(28)17-12-18(23(29)32-2)14-19(13-17)26-21(34)20(10-6-7-11-25)27-24(30)33-15-16-8-4-3-5-9-16;/h3-5,8-9,12-14,20H,6-7,10-11,15,25H2,1-2H3,(H,26,34)(H,27,30);1H/t20-;/m0./s1
• InChIKey: RCCRQGMEPWHXMY-BDQAORGHSA-N