Vitas-M small molecule compound
3-(2,5-dimethylphenyl)-1-[1-(3-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea
Catalog ID
STK959436
SMILES Cc1ccc(c(c1)NC(=S)N(C1CC(=O)N(C1=O)c1cccc(c1)C)Cc1c(C)nn(c1C)C)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 C27H31N5O2S MW 489.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O2S/c1-16-8-7-9-21(12-16)32-25(33)14-24(26(32)34)31(15-22-19(4)29-30(6)20(22)5)27(35)28-23-13-17(2)10-11-18(23)3/h7-13,24H,14-15H2,1-6H3,(H,28,35)InChIKey
HFPBIXUYKKLEKZ-UHFFFAOYSA-NSynonyms
492426-34-33(25dimethylphenyl)1(1(3methylphenyl)25dioxopyrrolidin3yl)1((135trimethyl1Hpyrazol4yl)methyl)thiourea
3(25DIMETHYLPHENYL)1(1(3METHYLPHENYL)25DIOXOPYRROLIDIN3YL)1((135TRIMETHYLPYRAZOL4YL)METHYL)THIOUREA
492426343
CC1=CC(=CC=C1)N2C(=O)CC(C2=O)N(CC3=C(N(N=C3C)C)C)C(=S)NC4=C(C=CC(=C4)C)C
InChI=1SC27H31N5O2Sc11687921(1216)3225(33)1424(26(32)34)31(152219(4)2930(6)20(22)5)27(35)28231317(2)101118(23)3h71324H1415H216H3(H2835)
MFCD02056526
ZINC000002758204
ZINC000096288451
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