Vitas-M small molecule compound
(2E)-N-cyclohexyl-2-{[3-(4-methylphenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}-3-phenylprop-2-enamide
Catalog ID
STL434816
SMILES Cc1ccc(cc1)c1n[nH]c(n1)S/C(=C/c1ccccc1)/C(=O)NC1CCCCC1
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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 C24H26N4OS MW 418.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4OS/c1-17-12-14-19(15-13-17)22-26-24(28-27-22)30-21(16-18-8-4-2-5-9-18)23(29)25-20-10-6-3-7-11-20/h2,4-5,8-9,12-16,20H,3,6-7,10-11H2,1H3,(H,25,29)(H,26,27,28)/b21-16+InChIKey
KVOBXXDAHXHACQ-LTGZKZEYSA-NSynonyms
(2E)Ncyclohexyl2((3(4methylphenyl)1H124triazol5yl)sulfanyl)3phenylprop2enamide
(E)Ncyclohexyl2((5(4methylphenyl)1H124triazol3yl)sulfanyl)3phenylprop2enamide
CC1=CC=C(C=C1)C2=NC(=NN2)SC(=CC3=CC=CC=C3)C(=O)NC4CCCCC4
Cc1ccc(cc1)c1n(nH)c(n1)SC(=Cc1ccccc1)C(=O)NC1CCCCC1
InChI=1SC24H26N4OSc117121419(151317)222624(282722)3021(16188425918)23(29)2520106371120h24589121620H3671011H21H3(H2529)(H262728)b2116+
MFCD30711435
ZINC000096336882
ZINC96336882
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