Vitas-M small molecule compound
methyl (2Z)-5-(propan-2-yl)-2-{[(Z)-N-(pyrimidin-2-yl)-beta-alanyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL318696
SMILES COC(=O)c1[nH]/c(=N/C(=O)CCNc2ncccn2)/sc1C(C)C
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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 C15H19N5O3S MW 349.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N5O3S/c1-9(2)12-11(13(22)23-3)20-15(24-12)19-10(21)5-8-18-14-16-6-4-7-17-14/h4,6-7,9H,5,8H2,1-3H3,(H,16,17,18)(H,19,20,21)InChIKey
ZETUNIVCGJDFQK-UHFFFAOYSA-NSynonyms
1435998-52-91435998529
CC(C)C1=C(N=C(S1)NC(=O)CCNC2=NC=CC=N2)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)CCNc2ncccn2)sc1C(C)C
InChI=1SC15H19N5O3Sc19(2)1211(13(22)233)2015(2412)1910(21)581814166471714h4679H58H213H3(H161718)(H192021)
methyl(2Z)5(propan2yl)2(((Z)N(pyrimidin2yl)betaalanyl)imino)23dihydro13thiazole4carboxylate
methyl5propan2yl2(3(pyrimidin2ylamino)propanoylamino)13thiazole4carboxylate
MFCD28031440
ZINC000095479499
ZINC95479499
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