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Basic Information |
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Product Name: | ANATIBANT |
CAS: | 209733-45-9 |
English Synonyms: | 2-PYRROLIDINECARBOXAMIDE, N-[3-[[4-(AMINOIMINOMETHYL)BENZOYL]AMINO]PROPYL]-1-[[2,4-DICHLORO-3-[[(2,4-DIMETHYL-8-QUINOLINYL)OXY]METHYL]PHENYL]SULFONYL]-, (2S)-, MONOMETHANESULFONATE ; ANATIBANT |
MDL Number.: | MFCD09833920 |
H bond acceptor: | 11 |
H bond donor: | 4 |
Smile: | Cc1cc(nc2c1cccc2OCc3c(ccc(c3Cl)S(=O)(=O)N4CCC[C@H]4C(=O)NCCCNC(=O)c5ccc(cc5)C(=N)N)Cl)C |
InChi: | InChI=1S/C34H36Cl2N6O5S/c1-20-18-21(2)41-31-24(20)6-3-8-28(31)47-19-25-26(35)13-14-29(30(25)36)48(45,46)42-17-4-7-27(42)34(44)40-16-5-15-39-33(43)23-11-9-22(10-12-23)32(37)38/h3,6,8-14,18,27H,4-5,7,15-17,19H2,1-2H3,(H3,37,38)(H,39,43)(H,40,44)/t27-/m0/s1 |
InChiKey: | InChIKey=XUHBBTKJWIBQMY-MHZLTWQESA-N |
* If the product has intellectual property rights, a license granted is must or contact us.