Vitas-M small molecule compound
1-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-3-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]thiourea
Catalog ID
STL391904
SMILES CCn1cc(c(n1)C)CNC(=S)Nc1c(C)nn(c1C)Cc1ccccc1C
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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 C21H28N6S MW 396.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N6S/c1-6-26-12-19(15(3)24-26)11-22-21(28)23-20-16(4)25-27(17(20)5)13-18-10-8-7-9-14(18)2/h7-10,12H,6,11,13H2,1-5H3,(H2,22,23,28)InChIKey
GQXVTWNTABUBPE-UHFFFAOYSA-NSynonyms
1005698-03-21(35DIMETHYL1((2METHYLPHENYL)METHYL)PYRAZOL4YL)3((1ETHYL3METHYLPYRAZOL4YL)METHYL)THIOUREA
1(35dimethyl1(2methylbenzyl)1Hpyrazol4yl)3((1ethyl3methyl1Hpyrazol4yl)methyl)thiourea
1005698032
CCN1C=C(C(=N1)C)CNC(=S)NC2=C(N(N=C2C)CC3=CC=CC=C3C)C
InChI=1SC21H28N6Sc16261219(15(3)2426)112221(28)232016(4)2527(17(20)5)13181087914(18)2h71012H61113H215H3(H2222328)
MFCD04133947
ZINC000002803063
ZINC02803063
ZINC2803063
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