CARBAMIC ACID, N-[(1S)-2-[[(1S,2R)-1-[(3,5-DIFLUOROPHENYL)METHYL]-3-[[(3-ETHYLPHENYL)METHYL]AMINO]-2-HYDROXYPROPYL]AMINO]-2-OXO-1-[[(1-PROPYLBUTYL)SULFONYL]METHYL]ETHYL]-, 3-PYRIDINYLMETHYL ESTER

pro_cas
477793-57-0
pro_cdbregno
CCD02500376
pro_formula
C36 H48 F2 N4 O6 S
pro_molWeight
702.859

basic_info

Product_Name: CARBAMIC ACID, N-[(1S)-2-[[(1S,2R)-1-[(3,5-DIFLUOROPHENYL)METHYL]-3-[[(3-ETHYLPHENYL)METHYL]AMINO]-2-HYDROXYPROPYL]AMINO]-2-OXO-1-[[(1-PROPYLBUTYL)SULFONYL]METHYL]ETHYL]-, 3-PYRIDINYLMETHYL ESTER
CAS: 477793-57-0
EnglishSynonyms: CARBAMIC ACID, N-[(1S)-2-[[(1S,2R)-1-[(3,5-DIFLUOROPHENYL)METHYL]-3-[[(3-ETHYLPHENYL)METHYL]AMINO]-2-HYDROXYPROPYL]AMINO]-2-OXO-1-[[(1-PROPYLBUTYL)SULFONYL]METHYL]ETHYL]-, 3-PYRIDINYLMETHYL ESTER
pro_mdlNumber: MFCD16038881
pro_acceptors: 10
pro_donors: 4
pro_smile: CCCC(CCC)S(=O)(=O)C[C@@H](C(=O)N[C@@H](Cc1cc(cc(c1)F)F)[C@@H](CNCc2cccc(c2)CC)O)NC(=O)OCc3cccnc3
InChi: InChI=1S/C36H48F2N4O6S/c1-4-9-31(10-5-2)49(46,47)24-33(42-36(45)48-23-27-13-8-14-39-21-27)35(44)41-32(18-28-16-29(37)19-30(38)17-28)34(43)22-40-20-26-12-7-11-25(6-3)15-26/h7-8,11-17,19,21,31-34,40,43H,4-6,9-10,18,20,22-24H2,1-3H3,(H,41,44)(H,42,45)/t32-,33-,34+/m0/s1
InChiKey: InChIKey=LGVMUCFKYMVFOU-DHWXLLNHSA-N

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