Vitas-M small molecule compound
3-(1H-benzimidazol-2-yl)-N'-[(E)-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1,2,2-trimethylcyclopentanecarbohydrazide
Catalog ID
STL398309
SMILES Cc1nn(c(c1/C=N/NC(=O)C1(C)CCC(C1(C)C)c1nc2c([nH]1)cccc2)C)c1ccccc1
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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 C28H32N6O MW 468.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N6O/c1-18-21(19(2)34(33-18)20-11-7-6-8-12-20)17-29-32-26(35)28(5)16-15-22(27(28,3)4)25-30-23-13-9-10-14-24(23)31-25/h6-14,17,22H,15-16H2,1-5H3,(H,30,31)(H,32,35)/b29-17+InChIKey
CBYGKVKPYJMJIG-STBIYBPSSA-NSynonyms
1005645-17-91005645179
3(1HBENZIMIDAZOL2YL)N((E)(35DIMETHYL1PHENYL1HPYRAZOL4YL)METHYLIDENE)122TRIMETHYLCYCLOPENTANECARBOHYDRAZIDE
3(1Hbenzimidazol2yl)N((E)(35dimethyl1phenylpyrazol4yl)methylideneamino)122trimethylcyclopentane1carboxamide
CC1=C(C(=NN1C2=CC=CC=C2)C)C=NNC(=O)C3(CCC(C3(C)C)C4=NC5=CC=CC=C5N4)C
Cc1nn(c(c1C=NNC(=O)C1(C)CCC(C1(C)C)c1nc2c((nH)1)cccc2)C)c1ccccc1
InChI=1SC28H32N6Oc11821(19(2)34(3318)20117681220)17293226(35)28(5)161522(27(283)4)253023139101424(23)3125h6141722H1516H215H3(H3031)(H3235)b2917+
MFCD04045986
ZINC000022704667
ZINC000022704679
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