Vitas-M small molecule compound
3,4-dimethoxy-N-{[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK011386
SMILES COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccncc1
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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 C22H18N4O4S MW 434.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O4S/c1-28-18-5-3-14(11-19(18)29-2)20(27)26-22(31)24-15-4-6-17-16(12-15)25-21(30-17)13-7-9-23-10-8-13/h3-12H,1-2H3,(H2,24,26,27,31)InChIKey
YWALSKTYLAJYBM-UHFFFAOYSA-NSynonyms
335213-70-21(34DIMETHOXYBENZOYL)3(2PYRIDIN4YLBENZOOXAZOL5YL)THIOUREA
335213702
34DIMETHOXYN((2(PYRIDIN4YL)13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
34dimethoxyN((2(pyridin4yl)benzo(d)oxazol5yl)carbamothioyl)benzamide
34dimethoxyN((2pyridin4yl13benzoxazol5yl)carbamothioyl)benzamide
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=NC=C4)OC
COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccncc1
InChI=1SC22H18N4O4Sc128185314(1119(18)292)20(27)2622(31)2415461716(1215)2521(3017)13792310813h312H12H3(H224262731)
MFCD02577946
STK011386
ZINC000000881517
ZINC00881517
ZINC881517
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