Vitas-M small molecule compound
methyl (2Z)-2-({[3-(furan-2-yl)-1H-pyrazol-5-yl]carbonyl}imino)-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL311663
SMILES COC(=O)c1[nH]/c(=N/C(=O)c2[nH]nc(c2)c2ccco2)/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 C16H16N4O4S MW 360.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O4S/c1-8(2)13-12(15(22)23-3)17-16(25-13)18-14(21)10-7-9(19-20-10)11-5-4-6-24-11/h4-8H,1-3H3,(H,19,20)(H,17,18,21)InChIKey
UPFPOYNWDWBHLV-UHFFFAOYSA-NSynonyms
1489258-07-21489258072
CC(C)C1=C(N=C(S1)NC(=O)C2=NNC(=C2)C3=CC=CO3)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)c2(nH)nc(c2)c2ccco2)sc1C(C)C
InChI=1SC16H16N4O4Sc18(2)1312(15(22)233)1716(2513)1814(21)1079(192010)115462411h48H13H3(H1920)(H171821)
methyl(2Z)2(((3(furan2yl)1Hpyrazol5yl)carbonyl)imino)5(propan2yl)23dihydro13thiazole4carboxylate
methyl2((5(furan2yl)1Hpyrazole3carbonyl)amino)5propan2yl13thiazole4carboxylate
MFCD28026223
ZINC000095474214
ZINC95474214
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