Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-4-(2-{[(2,6-dioxo-4-phenylcyclohexylidene)methyl]amino}ethyl)piperazine-1-carbothioamide
Catalog ID
STK074602
SMILES S=C(N1CCN(CC1)CCN/C=C/1\C(=O)CC(CC1=O)c1ccccc1)NCc1ccc2c(c1)OCO2
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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 C28H32N4O4S MW 520.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O4S/c33-24-15-22(21-4-2-1-3-5-21)16-25(34)23(24)18-29-8-9-31-10-12-32(13-11-31)28(37)30-17-20-6-7-26-27(14-20)36-19-35-26/h1-7,14,18,22,29H,8-13,15-17,19H2,(H,30,37)/b23-18-InChIKey
KTXQUPZXHHGYDV-NKFKGCMQSA-NSynonyms
525581-89-9525581899
MFCD03194589
N(13benzodioxol5ylmethyl)4(2(((26dioxo4phenylcyclohexylidene)methyl)amino)ethyl)piperazine1carbothioamide
N(benzo(d)(13)dioxol5ylmethyl)4(2(((26dioxo4phenylcyclohexylidene)methyl)amino)ethyl)piperazine1carbothioamide
S=C(N1CCN(CC1)CCNC=C1C(=O)CC(CC1=O)c1ccccc1)NCc1ccc2c(c1)OCO2
STK074602
ZINC000100425164
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