Vitas-M small molecule compound
ethyl [(2Z)-2-{[(1',3',5'-trimethyl-1H,1'H-3,4'-bipyrazol-5-yl)carbonyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate
Catalog ID
STL316154
SMILES CCOC(=O)Cc1cs/c(=N\C(=O)c2[nH]nc(c2)c2c(C)nn(c2C)C)/[nH]1
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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 C17H20N6O3S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N6O3S/c1-5-26-14(24)6-11-8-27-17(18-11)19-16(25)13-7-12(20-21-13)15-9(2)22-23(4)10(15)3/h7-8H,5-6H2,1-4H3,(H,20,21)(H,18,19,25)InChIKey
RQUNTKAEGUPWKS-UHFFFAOYSA-NSynonyms
1491130-03-01491130030
CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=NN2)C3=C(N(N=C3C)C)C
CCOC(=O)Cc1csc(=NC(=O)c2(nH)nc(c2)c2c(C)nn(c2C)C)(nH)1
ethyl((2Z)2(((135trimethyl1H1H34bipyrazol5yl)carbonyl)imino)23dihydro13thiazol4yl)acetate
ethyl2(2((3(135trimethylpyrazol4yl)1Hpyrazole5carbonyl)amino)13thiazol4yl)acetate
InChI=1SC17H20N6O3Sc152614(24)61182717(1811)1916(25)13712(202113)159(2)2223(4)10(15)3h78H56H214H3(H2021)(H181925)
MFCD28027654
ZINC000095477564
ZINC95477564
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