Vitas-M small molecule compound
4-butyl-N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide
Catalog ID
STL158914
SMILES CCCCc1nc(sc1C(=O)/N=c\1/[nH]nc(s1)COC)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 C16H19N5O2S2 MW 377.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5O2S2/c1-3-4-7-11-13(25-16(17-11)21-8-5-6-9-21)14(22)18-15-20-19-12(24-15)10-23-2/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,18,20,22)InChIKey
CHEFLQROPQKHQQ-UHFFFAOYSA-NSynonyms
1246064-63-01246064630
4butylN((2Z)5(methoxymethyl)134thiadiazol2(3H)ylidene)2(1Hpyrrol1yl)13thiazole5carboxamide
4butylN(5(methoxymethyl)134thiadiazol2yl)2pyrrol1yl13thiazole5carboxamide
CCCCC1=C(SC(=N1)N2C=CC=C2)C(=O)NC3=NN=C(S3)COC
CCCCc1nc(sc1C(=O)N=c1(nH)nc(s1)COC)n1cccc1
InChI=1SC16H19N5O2S2c13471113(2516(1711)21856921)14(22)1815201912(2415)10232h5689H34710H212H3(H182022)
MFCD20758519
ZINC000049544323
ZINC49544323
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