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CAS RN 169545-27-1

H3CONCH3OHNNHOOHCH3

CAS RN 169545-27-1

IUPAC Name: 2-(3-{[1,1'-biphenyl]-4-yl}-2-[1-(3,5-dimethylphenyl)-N-methylformamido]propanamido)-3-(1H-indol-3-yl)propanoic acid
Synonyms: 2-(3-{[1,1'-biphenyl]-4-yl}-2-[1-(3,5-dimethylphenyl)-N-methylformamido]propanamido)-3-(1H-indol-3-yl)propanoic acid
Molecular Weight (g/mol): 573.69
Molecular Formula: C36H35N3O4
InChi Key: UZDORQWMYRRLQV-UHFFFAOYNA-N
SMILES: CN(C(CC1=CC=C(C=C1)C1=CC=CC=C1)C(=O)NC(CC1=CNC2=CC=CC=C12)C(O)=O)C(=O)C1=CC(C)=CC(C)=C1

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IRL-2500, Tocris Bioscience™

CAS: 169545-27-1 Molecular Formula: C36H35N3O4 Molecular Weight (g/mol): 573.693 InChI Key: UZDORQWMYRRLQV-JHOUSYSJSA-N Synonym: chembl72410,2s-2-2r-2-3,5-dimethylbenzoyl-methylamino-3-4-phenylphenyl propanoyl amino-3-1h-indol-3-yl propanoic acid,tocris-1838,d01ede,n-3-1,1'-biphenyl-4-yl-n-3,5-dimethylbenzoyl-n-methyl-d-alanyl-l-tryptophan,2s-2-2r-3-1,1'-biphenyl-4-yl-2-1-3,5-dimethylphenyl-n-methylformamido propanamido-3-1h-indol-3-yl propanoic acid,s-2-r-3-biphenyl-4-yl-2-3,5-dimethyl-benzoyl-methyl-amino-propionylamino-3-1h-indol-3-yl-propionic acid PubChem CID: 5311192 IUPAC Name: (2S)-2-[[(2R)-2-[(3,5-dimethylbenzoyl)-methylamino]-3-(4-phenylphenyl)propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid SMILES: CC1=CC(=CC(=C1)C(=O)N(C)C(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)O)C

PubChem CID 5311192
CAS 169545-27-1
Molecular Weight (g/mol) 573.693
SMILES CC1=CC(=CC(=C1)C(=O)N(C)C(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)O)C
Synonym chembl72410,2s-2-2r-2-3,5-dimethylbenzoyl-methylamino-3-4-phenylphenyl propanoyl amino-3-1h-indol-3-yl propanoic acid,tocris-1838,d01ede,n-3-1,1'-biphenyl-4-yl-n-3,5-dimethylbenzoyl-n-methyl-d-alanyl-l-tryptophan,2s-2-2r-3-1,1'-biphenyl-4-yl-2-1-3,5-dimethylphenyl-n-methylformamido propanamido-3-1h-indol-3-yl propanoic acid,s-2-r-3-biphenyl-4-yl-2-3,5-dimethyl-benzoyl-methyl-amino-propionylamino-3-1h-indol-3-yl-propionic acid
IUPAC Name (2S)-2-[[(2R)-2-[(3,5-dimethylbenzoyl)-methylamino]-3-(4-phenylphenyl)propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
InChI Key UZDORQWMYRRLQV-JHOUSYSJSA-N
Molecular Formula C36H35N3O4