Vitas-M small molecule compound
methyl 2-({[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonothioyl}amino)-4,5-dimethoxybenzoate
Catalog ID
STK868366
SMILES COC(=O)c1cc(OC)c(cc1NC(=S)N1CCN(CC1)Cc1ccc2c(c1)OCO2)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 C23H27N3O6S MW 473.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O6S/c1-28-19-11-16(22(27)30-3)17(12-20(19)29-2)24-23(33)26-8-6-25(7-9-26)13-15-4-5-18-21(10-15)32-14-31-18/h4-5,10-12H,6-9,13-14H2,1-3H3,(H,24,33)InChIKey
IBVAXZFKNPDNRE-UHFFFAOYSA-NSynonyms
717832-29-6717832296
COC1=C(C=C(C(=C1)C(=O)OC)NC(=S)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OC
InChI=1SC23H27N3O6Sc128191116(22(27)303)17(1220(19)292)2423(33)268625(7926)1315451821(1015)32143118h451012H691314H213H3(H2433)
methyl2(((4(13benzodioxol5ylmethyl)piperazin1yl)carbonothioyl)amino)45dimethoxybenzoate
METHYL2((4(13BENZODIOXOL5YLMETHYL)PIPERAZINE1CARBOTHIOYL)AMINO)45DIMETHOXYBENZOATE
methyl2(4(benzo(d)(13)dioxol5ylmethyl)piperazine1carbothioamido)45dimethoxybenzoate
MFCD06006700
ZINC000020481872
ZINC20481872
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