Vitas-M small molecule compound
1-(2-cyanoethyl)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-methylthiourea
Catalog ID
STK773459
SMILES N#CCCN(C(=S)Nc1c(C)n(n(c1=O)c1ccccc1)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 C16H19N5OS MW 329.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5OS/c1-12-14(18-16(23)19(2)11-7-10-17)15(22)21(20(12)3)13-8-5-4-6-9-13/h4-6,8-9H,7,11H2,1-3H3,(H,18,23)InChIKey
KQEKMHNRAMXWJW-UHFFFAOYSA-NSynonyms
1(2cyanoethyl)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)1methylthiourea
1(2CYANOETHYL)3(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)1METHYLTHIOUREA
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)N(C)CCC#N
InChI=1SC16H19N5OSc11214(1816(23)19(2)1171017)15(22)21(20(12)3)138546913h4689H711H213H3(H1823)
MFCD03760398
ZINC000003627098
ZINC03627098
ZINC3627098
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