Vitas-M small molecule compound
1-(2-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]amino}-2-oxoethyl)-1H-pyrazole-3-carboxylic acid
Catalog ID
STL391168
SMILES CCn1ncc(c1CNC(=O)Cn1ccc(n1)C(=O)O)Cl
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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 C12H14ClN5O3 MW 311.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14ClN5O3/c1-2-18-10(8(13)5-15-18)6-14-11(19)7-17-4-3-9(16-17)12(20)21/h3-5H,2,6-7H2,1H3,(H,14,19)(H,20,21)InChIKey
AJXWPTSZWROXRE-UHFFFAOYSA-NSynonyms
1174834-40-21(2(((4chloro1ethyl1Hpyrazol5yl)methyl)amino)2oxoethyl)1Hpyrazole3carboxylicacid
1(2((4chloro2ethylpyrazol3yl)methylamino)2oxoethyl)pyrazole3carboxylicacid
1174834402
CCN1C(=C(C=N1)Cl)CNC(=O)CN2C=CC(=N2)C(=O)O
InChI=1SC12H14ClN5O3c121810(8(13)51518)61411(19)717439(1617)12(20)21h35H267H21H3(H1419)(H2021)
MFCD09469802
ZINC000020614807
ZINC20614807
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