Vitas-M small molecule compound
2-(4-chlorobenzyl)-N,N'-bis(6-methoxy-1,3-benzothiazol-2-yl)butanediamide
Catalog ID
STK684782
SMILES COc1ccc2c(c1)sc(n2)NC(=O)CC(C(=O)Nc1nc2c(s1)cc(cc2)OC)Cc1ccc(cc1)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H23ClN4O4S2 MW 567.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClN4O4S2/c1-35-18-7-9-20-22(13-18)37-26(29-20)31-24(33)12-16(11-15-3-5-17(28)6-4-15)25(34)32-27-30-21-10-8-19(36-2)14-23(21)38-27/h3-10,13-14,16H,11-12H2,1-2H3,(H,29,31,33)(H,30,32,34)InChIKey
XTQGBRKLCXPQKH-UHFFFAOYSA-NSynonyms
2((4CHLOROPHENYL)METHYL)NNBIS(6METHOXY13BENZOTHIAZOL2YL)BUTANEDIAMIDE
2(4CHLOROBENZYL)NNBIS(6METHOXY13BENZOTHIAZOL2YL)BUTANEDIAMIDE
COC1=CC2=C(C=C1)N=C(S2)NC(=O)CC(CC3=CC=C(C=C3)Cl)C(=O)NC4=NC5=C(S4)C=C(C=C5)OC
InChI=1SC27H23ClN4O4S2c13518792022(1318)3726(2920)3124(33)1216(11153517(28)6415)25(34)3227302110819(362)1423(21)3827h310131416H1112H212H3(H293133)(H303234)
MFCD05856092
ZINC000100172373
ZINC000100172375
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