Vitas-M small molecule compound
methyl (2E)-2-{[(2-chloro-5-methyl-1,3-thiazol-4-yl)carbonyl]imino}-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL407341
SMILES COC(=O)c1[nH]/c(=N\C(=O)c2nc(sc2C)Cl)/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 C13H14ClN3O3S2 MW 359.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14ClN3O3S2/c1-5(2)9-8(11(19)20-4)16-13(22-9)17-10(18)7-6(3)21-12(14)15-7/h5H,1-4H3,(H,16,17,18)InChIKey
FLXPGBDCRKURNN-UHFFFAOYSA-NSynonyms
1574361-37-71574361377
CC1=C(N=C(S1)Cl)C(=O)NC2=NC(=C(S2)C(C)C)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)c2nc(sc2C)Cl)sc1C(C)C
InChI=1SC13H14ClN3O3S2c15(2)98(11(19)204)1613(229)1710(18)76(3)2112(14)157h5H14H3(H161718)
methyl(2E)2(((2chloro5methyl13thiazol4yl)carbonyl)imino)5(propan2yl)23dihydro13thiazole4carboxylate
methyl2((2chloro5methyl13thiazole4carbonyl)amino)5propan2yl13thiazole4carboxylate
MFCD30704694
ZINC000096231625
ZINC96231625
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