Vitas-M small molecule compound
1-(3,5-dimethylphenyl)-3-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(4-methoxyphenyl)ethyl]amino}methylidene]thiourea
Catalog ID
STL482218
SMILES COc1ccc(cc1)CCN/C(=N\C(=S)Nc1cc(C)cc(c1)C)/Nc1nc(C)cc(n1)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 C25H30N6OS MW 462.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N6OS/c1-16-12-17(2)14-21(13-16)29-25(33)31-23(30-24-27-18(3)15-19(4)28-24)26-11-10-20-6-8-22(32-5)9-7-20/h6-9,12-15H,10-11H2,1-5H3,(H3,26,27,28,29,30,31,33)InChIKey
ORJNEJMRDFSBME-UHFFFAOYSA-NSynonyms
(E)1(35DIMETHYLPHENYL)3((46DIMETHYLPYRIMIDIN2YLAMINO)(4METHOXYPHENETHYLAMINO)METHYLENE)THIOUREA
1(35dimethylphenyl)3((E)((46dimethylpyrimidin2yl)amino)((2(4methoxyphenyl)ethyl)amino)methylidene)thiourea
1(35DIMETHYLPHENYL)3(N(46DIMETHYLPYRIMIDIN2YL)N(2(4METHOXYPHENYL)ETHYL)CARBAMIMIDOYL)THIOUREA
CC1=CC(=CC(=C1)NC(=S)NC(=NCCC2=CC=C(C=C2)OC)NC3=NC(=CC(=N3)C)C)C
COc1ccc(cc1)CCNC(=NC(=S)Nc1cc(C)cc(c1)C)Nc1nc(C)cc(n1)C
InChI=1SC25H30N6OSc1161217(2)1421(1316)2925(33)3123(30242718(3)1519(4)2824)261110206822(325)9720h691215H1011H215H3(H326272829303133)
MFCD05656481
ZINC000014157025
ZINC14157025
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