Vitas-M small molecule compound
N'-[1-(4-fluorophenyl)ethylidene]-2-[(5-{[(2-methoxyphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanehydrazide
Catalog ID
STL174622
SMILES COc1ccccc1NCc1nnc(n1c1ccccc1)SC(C(=O)N/N=C(/c1ccc(cc1)F)\C)C
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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 C27H27FN6O2S MW 518.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27FN6O2S/c1-18(20-13-15-21(28)16-14-20)30-32-26(35)19(2)37-27-33-31-25(34(27)22-9-5-4-6-10-22)17-29-23-11-7-8-12-24(23)36-3/h4-16,19,29H,17H2,1-3H3,(H,32,35)InChIKey
HUPKJNNYKSULDO-UHFFFAOYSA-NSynonyms
438618-17-8438618178
CC(C(=O)NN=C(C)C1=CC=C(C=C1)F)SC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=CC=C4OC
COc1ccccc1NCc1nnc(n1c1ccccc1)SC(C(=O)NN=C(c1ccc(cc1)F)C)C
InChI=1SC27H27FN6O2Sc118(20131521(28)161420)303226(35)19(2)3727333125(34(27)2295461022)17292311781224(23)363h4161929H17H213H3(H3235)
MFCD01437416
N(1(4fluorophenyl)ethylidene)2((5(((2methoxyphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)propanehydrazide
N(1(4FLUOROPHENYL)ETHYLIDENEAMINO)2((5((2METHOXYANILINO)METHYL)4PHENYL124TRIAZOL3YL)SULFANYL)PROPANAMIDE
ZINC000245239326
ZINC000245239327
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