Cas no 338990-63-9 (NND-2252305)

NND-2252305 structure
NND-2252305 structure
Product Name:NND-2252305
CAS No:338990-63-9
MF:C40H43ClF2N8O7S
MW:853.33
CID:5037623
Update Time:2022-05-23

NND-2252305 Chemical and Physical Properties

Names and Identifiers

    • 4H-?1,?2,?4-?Triazolium, 1-?[(2R,?3R)?-?3-?[4-?(4-?cyanophenyl)?-?2-?thiazolyl]?-?2-?(2,?5-?difluorophenyl)?-?2-?hydroxybutyl]?-?4-?[1-?[[[[3-?[[[2-?[[(1,?1-?dimethylethoxy)?carbonyl]?methylamino]?acetyl]?oxy]?methyl]?-?2-?pyridinyl]?methylamino]?carbonyl]?oxy]?ethyl]?-?, chloride (1:1)
    • NND-2252305
    • Inchi: 1S/C40H43F2N8O7S.ClH/c1-25(36-46-33(21-58-36)28-12-10-27(18-43)11-13-28)40(54,31-17-30(41)14-15-32(31)42)22-50-24-49(23-45-50)26(2)56-38(53)48(7)35-29(9-8-16-44-35)20-55-34(51)19-47(6)37(52)57-39(3,4)5;/h8-17,21,23-26,54H,19-20,22H2,1-7H3;1H/q+1;/p-1/t25-,26?,40+;/m0./s1
    • InChI Key: MQJPVALDLKBJKP-CYDMSEOTSA-M
    • SMILES: C1C(COC(=O)CN(C(OC(C)(C)C)=O)C)=C(N=CC=1)N(C(=O)OC(C)[N+]1C=NN(C[C@@]([C@@H](C)C2=NC(=CS2)C2C=CC(=CC=2)C#N)(C2C=C(F)C=CC=2F)O)C=1)C.[Cl-]
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