Vitas-M small molecule compound
1-{(Z)-[(4,6-dimethylpyrimidin-2-yl)amino][(pyridin-3-ylmethyl)amino]methylidene}-3-phenylthiourea
Catalog ID
STL482211
SMILES S=C(Nc1ccccc1)/N=C(\Nc1nc(C)cc(n1)C)/NCc1cccnc1
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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 C20H21N7S MW 391.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N7S/c1-14-11-15(2)24-19(23-14)26-18(22-13-16-7-6-10-21-12-16)27-20(28)25-17-8-4-3-5-9-17/h3-12H,13H2,1-2H3,(H3,22,23,24,25,26,27,28)InChIKey
VLFPMLNAURFEQE-UHFFFAOYSA-NSynonyms
1((Z)((46dimethylpyrimidin2yl)amino)((pyridin3ylmethyl)amino)methylidene)3phenylthiourea
1(N(46DIMETHYLPYRIMIDIN2YL)N(PYRIDIN3YLMETHYL)CARBAMIMIDOYL)3PHENYLTHIOUREA
CC1=CC(=NC(=N1)NC(=NCC2=CN=CC=C2)NC(=S)NC3=CC=CC=C3)C
InChI=1SC20H21N7Sc1141115(2)2419(2314)2618(2213167610211216)2720(28)25178435917h312H13H212H3(H322232425262728)
MFCD06253001
N((1Z)((46DIMETHYLPYRIMIDIN2YL)AMINO)((PYRIDIN3YLMETHYL)AMINO)METHYLENE)NPHENYLTHIOUREA
S=C(Nc1ccccc1)N=C(Nc1nc(C)cc(n1)C)NCc1cccnc1
ZINC000014157645
ZINC14157645
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