RDEA-806

CAS No.
878670-63-4
CCD No.
CCD04334219
Formula
C24 H17 Br Cl N4 O3 S . K
MolWeight
595.944

Basic Information

Product Name: RDEA-806
CAS: 878670-63-4
English Synonyms: POTASSIUM 4-(2-([5-BROMO-4-(4-CYCLOPROPYLNAPHTHALEN-1-YL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETAMIDO)-3-CHLOROBENZOATE ; RDEA-806
MDL Number.: MFCD18633288
H bond acceptor: 7
H bond donor: 1
Smile: c1ccc2c(c1)c(ccc2n3c(nnc3Br)SCC(=O)Nc4ccc(cc4Cl)C(=O)[O-])C5CC5.[K+]
InChi: InChI=1S/C24H18BrClN4O3S.K/c25-23-28-29-24(34-12-21(31)27-19-9-7-14(22(32)33)11-18(19)26)30(23)20-10-8-15(13-5-6-13)16-3-1-2-4-17(16)20;/h1-4,7-11,13H,5-6,12H2,(H,27,31)(H,32,33);/q;+1/p-1
InChiKey: InChIKey=ZVIWEYTXPYNLGB-UHFFFAOYSA-M

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