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Basic Information |
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Product Name: | 3-[3-(1,1-DIMETHYLETHYL)-5-[(3-ISOQUINOLINYLCARBONYL)AMINO]-1H-PYRAZOL-1-YL]-BENZENEPROPANOIC ACID |
CAS: | 872171-26-1 |
English Synonyms: | BENZENEPROPANOIC ACID, 3-[3-(1,1-DIMETHYLETHYL)-5-[(3-ISOQUINOLINYLCARBONYL)AMINO]-1H-PYRAZOL-1-YL]- ; 3-[3-(1,1-DIMETHYLETHYL)-5-[(3-ISOQUINOLINYLCARBONYL)AMINO]-1H-PYRAZOL-1-YL]-BENZENEPROPANOIC ACID |
MDL Number.: | MFCD16878701 |
H bond acceptor: | 7 |
H bond donor: | 2 |
Smile: | CC(C)(C)C1=NN(C(=C1)NC(=O)C=1N=CC2=CC=CC=C2C1)C=1C=C(C=CC1)CCC(=O)O |
InChi: | InChI=1S/C26H26N4O3/c1-26(2,3)22-15-23(28-25(33)21-14-18-8-4-5-9-19(18)16-27-21)30(29-22)20-10-6-7-17(13-20)11-12-24(31)32/h4-10,13-16H,11-12H2,1-3H3,(H,28,33)(H,31,32) |
InChiKey: | InChIKey=LWRFKKBIYPTNPQ-UHFFFAOYSA-N |
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