Vitas-M small molecule compound
1-{(Z)-(benzylamino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-(2,3-dimethylphenyl)thiourea
Catalog ID
STK189829
SMILES S=C(Nc1cccc(c1C)C)/N=C(\Nc1nc(C)cc(n1)C)/NCc1ccccc1
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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 C23H26N6S MW 418.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N6S/c1-15-9-8-12-20(18(15)4)27-23(30)29-21(24-14-19-10-6-5-7-11-19)28-22-25-16(2)13-17(3)26-22/h5-13H,14H2,1-4H3,(H3,24,25,26,27,28,29,30)InChIKey
SIEUWICDQQMQBQ-UHFFFAOYSA-NSynonyms
(Z)1((BENZYLAMINO)(46DIMETHYLPYRIMIDIN2YLAMINO)METHYLENE)3(23DIMETHYLPHENYL)THIOUREA
1((Z)(BENZYLAMINO)((46DIMETHYLPYRIMIDIN2YL)AMINO)METHYLIDENE)3(23DIMETHYLPHENYL)THIOUREA
1(NBENZYLN(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)3(23DIMETHYLPHENYL)THIOUREA
CC1=C(C(=CC=C1)NC(=S)NC(=NCC2=CC=CC=C2)NC3=NC(=CC(=N3)C)C)C
InChI=1SC23H26N6Sc115981220(18(15)4)2723(30)2921(241419106571119)28222516(2)1317(3)2622h513H14H214H3(H324252627282930)
MFCD05993074
S=C(Nc1cccc(c1C)C)N=C(Nc1nc(C)cc(n1)C)NCc1ccccc1
ZINC000016361790
ZINC16361790
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