Vitas-M small molecule compound

(5E)-1-benzyl-5-[(1-butyl-2,3-dihydro-1H-indol-5-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STL049286
SMILES CCCCN1CCc2c1ccc(c2)/C=C/1\C(=O)N=C(N(C1=O)Cc1ccccc1)S

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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 C24H25N3O2S MW 419.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O2S/c1-2-3-12-26-13-11-19-14-18(9-10-21(19)26)15-20-22(28)25-24(30)27(23(20)29)16-17-7-5-4-6-8-17/h4-10,14-15H,2-3,11-13,16H2,1H3,(H,25,28,30)/b20-15+
InChIKey
WUYCSBMJBGBAAY-HMMYKYKNSA-N
Synonyms
714945-81-0
(5E)1benzyl5((1butyl23dihydro1Hindol5yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1BENZYL5((1BUTYL23DIHYDROINDOL5YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
714945810
CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=S)N(C3=O)CC4=CC=CC=C4
CCCCN1CCc2c1ccc(c2)C=C1C(=O)N=C(N(C1=O)Cc1ccccc1)S
InChI=1SC24H25N3O2Sc12312261311191418(91021(19)26)152022(28)2524(30)27(23(20)29)16177546817h4101415H23111316H21H3(H252830)b2015+
MFCD05737156
ZINC000002591480
ZINC2591480

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Available files

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