Vitas-M small molecule compound

1-[1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-3-[4-(dimethylamino)phenyl]-1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]thiourea

Catalog ID
STL405437
SMILES CCCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=S)Nc1ccc(cc1)N(C)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 C29H36N6O3S MW 548.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N6O3S/c1-6-7-16-38-25-14-12-24(13-15-25)35-27(36)17-26(28(35)37)34(19-21-18-33(5)31-20(21)2)29(39)30-22-8-10-23(11-9-22)32(3)4/h8-15,18,26H,6-7,16-17,19H2,1-5H3,(H,30,39)
InChIKey
IUYGOHBLNFIADE-UHFFFAOYSA-N
Synonyms
1038396-95-0
1(1(4butoxyphenyl)25dioxopyrrolidin3yl)3(4(dimethylamino)phenyl)1((13dimethyl1Hpyrazol4yl)methyl)thiourea
1(1(4butoxyphenyl)25dioxopyrrolidin3yl)3(4(dimethylamino)phenyl)1((13dimethylpyrazol4yl)methyl)thiourea
1(1(4BUTOXYPHENYL)25DIOXOPYRROLIDIN3YL)3(4DIMETHYLAMINOPHENYL)1((13DIMETHYLPYRAZOL4YL)METHYL)THIOUREA
1038396950
CCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CC3=CN(N=C3C)C)C(=S)NC4=CC=C(C=C4)N(C)C
InChI=1SC29H36N6O3Sc167163825141224(131525)3527(36)1726(28(35)37)34(19211833(5)3120(21)2)29(39)302281023(11922)32(3)4h8151826H67161719H215H3(H3039)
MFCD01923179
ZINC000097948007
ZINC000101531609

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Available files

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