(2S,5R,6R)-6-[[(R)-[[(2,3-Dioxo-4-Propylpiperazin-1-Yl)Carbonyl]Amino]Phenylacetyl]Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid
[CAS# 65125-88-4]

Identification

• Name: (2S,5R,6R)-6-[[(R)-[[(2,3-Dioxo-4-Propylpiperazin-1-Yl)Carbonyl]Amino]Phenylacetyl]Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid
• Synonyms: (2S,5R,6R)-6-[[2-[(2,3-Dioxo-4-Propyl-Piperazine-1-Carbonyl)Amino]-2-Phenyl-Acetyl]Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; (2S,5R,6R)-6-[[2-[[(2,3-Dioxo-4-Propyl-1-Piperazinyl)-Oxomethyl]Amino]-1-Oxo-2-Phenylethyl]Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; (2S,5R,6R)-6-[[2-[(2,3-Diketo-4-Propyl-Piperazine-1-Carbonyl)Amino]-2-Phenyl-Acetyl]Amino]-7-Keto-3,3-Dimethyl-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid
• Molecular Formula: C₂₄H₂₉N₅O₇S
• Molecular Weight: 531.58
• CAS Registry Number: 65125-88-4
• SMILES: [C@H]12SC([C@@H](N1C(=O)[C@H]2NC(=O)C(NC(=O)N3C(=O)C(=O)N(CC3)CCC)C4=CC=CC=C4)C(=O)O)(C)C
• InChI: 1S/C24H29N5O7S/c1-4-10-27-11-12-28(20(33)19(27)32)23(36)26-14(13-8-6-5-7-9-13)17(30)25-15-18(31)29-16(22(34)35)24(2,3)37-21(15)29/h5-9,14-16,21H,4,10-12H2,1-3H3,(H,25,30)(H,26,36)(H,34,35)/t14?,15-,16+,21-/m1/s1
• InChIKey: ONGHZPONCZIAJY-KHYDYBCDSA-N