Vitas-M small molecule compound
1-[1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-3-(4-methylphenyl)thiourea
Catalog ID
STL405323
SMILES CCCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=S)Nc1ccc(cc1)C)Cc1cn(nc1C)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 C28H33N5O3S MW 519.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N5O3S/c1-5-6-15-36-24-13-11-23(12-14-24)33-26(34)16-25(27(33)35)32(18-21-17-31(4)30-20(21)3)28(37)29-22-9-7-19(2)8-10-22/h7-14,17,25H,5-6,15-16,18H2,1-4H3,(H,29,37)InChIKey
YHOKRTOFTUKXNN-UHFFFAOYSA-NSynonyms
1042164-99-71(1(4butoxyphenyl)25dioxopyrrolidin3yl)1((13dimethyl1Hpyrazol4yl)methyl)3(4methylphenyl)thiourea
1(1(4BUTOXYPHENYL)25DIOXOPYRROLIDIN3YL)1((13DIMETHYLPYRAZOL4YL)METHYL)3(4METHYLPHENYL)THIOUREA
1042164997
CCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CC3=CN(N=C3C)C)C(=S)NC4=CC=C(C=C4)C
InChI=1SC28H33N5O3Sc156153624131123(121424)3326(34)1625(27(33)35)32(18211731(4)3020(21)3)28(37)29229719(2)81022h7141725H56151618H214H3(H2937)
MFCD01923309
ZINC000020617893
ZINC000101531519
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