Vitas-M small molecule compound
4-(4-methoxyphenyl)-2-(1H-pyrrol-1-yl)-N-[(2Z)-5-(tetrahydrofuran-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-1,3-thiazole-5-carboxamide
Catalog ID
STL158548
SMILES COc1ccc(cc1)c1nc(sc1C(=O)/N=c\1/[nH]nc(s1)C1CCCO1)n1cccc1
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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 C21H19N5O3S2 MW 453.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3S2/c1-28-14-8-6-13(7-9-14)16-17(30-21(22-16)26-10-2-3-11-26)18(27)23-20-25-24-19(31-20)15-5-4-12-29-15/h2-3,6-11,15H,4-5,12H2,1H3,(H,23,25,27)InChIKey
DZLONAFVKPWKDI-UHFFFAOYSA-NSynonyms
1282140-35-51282140355
4(4methoxyphenyl)2(1Hpyrrol1yl)N((2Z)5(tetrahydrofuran2yl)134thiadiazol2(3H)ylidene)13thiazole5carboxamide
4(4methoxyphenyl)N(5(oxolan2yl)134thiadiazol2yl)2pyrrol1yl13thiazole5carboxamide
COC1=CC=C(C=C1)C2=C(SC(=N2)N3C=CC=C3)C(=O)NC4=NN=C(S4)C5CCCO5
COc1ccc(cc1)c1nc(sc1C(=O)N=c1(nH)nc(s1)C1CCCO1)n1cccc1
InChI=1SC21H19N5O3S2c128148613(7914)1617(3021(2216)2610231126)18(27)2320252419(3120)1554122915h2361115H4512H21H3(H232527)
MFCD20758385
ZINC000061721222
ZINC000061721223
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