Vitas-M small molecule compound
1-{(Z)-(cyclopentylamino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-(3,5-dimethylphenyl)thiourea
Catalog ID
STK189830
SMILES S=C(Nc1cc(C)cc(c1)C)/N=C(\Nc1nc(C)cc(n1)C)/NC1CCCC1
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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/c1-13-9-14(2)11-18(10-13)25-21(28)27-20(24-17-7-5-6-8-17)26-19-22-15(3)12-16(4)23-19/h9-12,17H,5-8H2,1-4H3,(H3,22,23,24,25,26,27,28)InChIKey
MZFHNTSCROZHMU-UHFFFAOYSA-NSynonyms
(Z)1((CYCLOPENTYLAMINO)(46DIMETHYLPYRIMIDIN2YLAMINO)METHYLENE)3(35DIMETHYLPHENYL)THIOUREA
1((Z)(CYCLOPENTYLAMINO)((46DIMETHYLPYRIMIDIN2YL)AMINO)METHYLIDENE)3(35DIMETHYLPHENYL)THIOUREA
1(NCYCLOPENTYLN(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)3(35DIMETHYLPHENYL)THIOUREA
CC1=CC(=CC(=C1)NC(=S)NC(=NC2CCCC2)NC3=NC(=CC(=N3)C)C)C
InChI=1SC21H28N6Sc113914(2)1118(1013)2521(28)2720(2417756817)26192215(3)1216(4)2319h91217H58H214H3(H322232425262728)
MFCD05656478
S=C(Nc1cc(C)cc(c1)C)N=C(Nc1nc(C)cc(n1)C)NC1CCCC1
ZINC000004711813
ZINC04711813
ZINC4711813
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