Vitas-M small molecule compound
N-cyclohexyl-3-[(2E)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-(3,4,5-trimethoxybenzylidene)hydrazinyl]propanamide
Catalog ID
STK131134
SMILES COc1cc(/C=N/N(C2=NS(=O)(=O)c3c2cccc3)CCC(=O)NC2CCCCC2)cc(c1OC)OC
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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 C26H32N4O6S MW 528.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O6S/c1-34-21-15-18(16-22(35-2)25(21)36-3)17-27-30(14-13-24(31)28-19-9-5-4-6-10-19)26-20-11-7-8-12-23(20)37(32,33)29-26/h7-8,11-12,15-17,19H,4-6,9-10,13-14H2,1-3H3,(H,28,31)/b27-17+InChIKey
IYPGFVOKSINDJA-WPWMEQJKSA-NSynonyms
COC1=CC(=CC(=C1OC)OC)C=NN(CCC(=O)NC2CCCCC2)C3=NS(=O)(=O)C4=CC=CC=C43
COc1cc(C=NN(C2=NS(=O)(=O)c3c2cccc3)CCC(=O)NC2CCCCC2)cc(c1OC)OC
InChI=1SC26H32N4O6Sc134211518(1622(352)25(21)363)172730(141324(31)281995461019)262011781223(20)37(3233)2926h781112151719H469101314H213H3(H2831)b2717+
MFCD03215093
Ncyclohexyl3((11dioxo12benzothiazol3yl)((E)(345trimethoxyphenyl)methylideneamino)amino)propanamide
NCYCLOHEXYL3((2E)1(11DIOXIDO12BENZOTHIAZOL3YL)2(345TRIMETHOXYBENZYLIDENE)HYDRAZINYL)PROPANAMIDE
ZINC000009850161
ZINC33715264
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