Vitas-M small molecule compound
N-[3-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STK336701
SMILES CCc1nnc2n1nc(s2)c1cccc(c1)NC(=O)c1ccc2c(c1)OCCO2
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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 C20H17N5O3S MW 407.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5O3S/c1-2-17-22-23-20-25(17)24-19(29-20)13-4-3-5-14(10-13)21-18(26)12-6-7-15-16(11-12)28-9-8-27-15/h3-7,10-11H,2,8-9H2,1H3,(H,21,26)InChIKey
PYCGOYAZEUNERY-UHFFFAOYSA-NSynonyms
CCC1=NN=C2N1N=C(S2)C3=CC(=CC=C3)NC(=O)C4=CC5=C(C=C4)OCCO5
InChI=1SC20H17N5O3Sc121722232025(17)2419(2920)1343514(1013)2118(26)12671516(1112)28982715h371011H289H21H3(H2126)
MFCD07176160
N(3(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)23dihydro14benzodioxine6carboxamide
ZINC000008071416
ZINC08071416
ZINC8071416
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