Vitas-M small molecule compound
6-tert-butyl-N-cyclohexyl-2-{[(E)-(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK449917
SMILES CCn1nc(c(c1)/C=N/c1sc2c(c1C(=O)NC1CCCCC1)CCC(C2)C(C)(C)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 C26H38N4OS MW 454.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H38N4OS/c1-6-30-16-18(17(2)29-30)15-27-25-23(24(31)28-20-10-8-7-9-11-20)21-13-12-19(26(3,4)5)14-22(21)32-25/h15-16,19-20H,6-14H2,1-5H3,(H,28,31)/b27-15+InChIKey
YBKSUKDYZZPYBT-JFLMPSFJSA-NSynonyms
6tertbutylNcyclohexyl2(((E)(1ethyl3methyl1Hpyrazol4yl)methylidene)amino)4567tetrahydro1benzothiophene3carboxamide
6tertbutylNcyclohexyl2((E)(1ethyl3methylpyrazol4yl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
CCN1C=C(C(=N1)C)C=NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)NC4CCCCC4
CCn1nc(c(c1)C=Nc1sc2c(c1C(=O)NC1CCCCC1)CCC(C2)C(C)(C)C)C
InChI=1SC26H38N4OSc16301618(17(2)2930)15272523(24(31)2820108791120)21131219(26(34)5)1422(21)3225h15161920H614H215H3(H2831)b2715+
MFCD03467617
ZINC000002788558
ZINC000002788560
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