Vitas-M small molecule compound
N'-[(E)-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}methylidene]-2-({5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
Catalog ID
STL176548
SMILES COc1ccc(cc1COc1ccc(cc1)Br)/C=N/NC(=O)CSc1nnc(n1CC)C1CC1c1ccc(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 C30H29BrClN5O3S MW 655.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29BrClN5O3S/c1-3-37-29(26-15-25(26)20-5-9-23(32)10-6-20)35-36-30(37)41-18-28(38)34-33-16-19-4-13-27(39-2)21(14-19)17-40-24-11-7-22(31)8-12-24/h4-14,16,25-26H,3,15,17-18H2,1-2H3,(H,34,38)/b33-16+InChIKey
BEXJTHPJOQKMIV-MHDJOFBISA-NSynonyms
828272-69-1828272691
CCN1C(=NN=C1SCC(=O)NN=CC2=CC(=C(C=C2)OC)COC3=CC=C(C=C3)Br)C4CC4C5=CC=C(C=C5)Cl
COc1ccc(cc1COc1ccc(cc1)Br)C=NNC(=O)CSc1nnc(n1CC)C1CC1c1ccc(cc1)Cl
InChI=1SC30H29BrClN5O3Sc133729(261525(26)205923(32)10620)353630(37)411828(38)3433161941327(392)21(1419)17402411722(31)81224h414162526H3151718H212H3(H3438)b3316+
MFCD04049268
N((E)(3((4bromophenoxy)methyl)4methoxyphenyl)methylidene)2((5(2(4chlorophenyl)cyclopropyl)4ethyl4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(3((4bromophenoxy)methyl)4methoxyphenyl)methylideneamino)2((5(2(4chlorophenyl)cyclopropyl)4ethyl124triazol3yl)sulfanyl)acetamide
ZINC000150393597
ZINC000150393616
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