Vitas-M small molecule compound
(5E)-1-benzyl-5-[(1-propyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL053012
SMILES CCCn1cc(c2c1cccc2)/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 C23H21N3O2S MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2S/c1-2-12-25-15-17(18-10-6-7-11-20(18)25)13-19-21(27)24-23(29)26(22(19)28)14-16-8-4-3-5-9-16/h3-11,13,15H,2,12,14H2,1H3,(H,24,27,29)/b19-13+InChIKey
VKELPFUOOIDKCV-CPNJWEJPSA-NSynonyms
573973-28-1(5E)1benzyl5((1propyl1Hindol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1BENZYL5((1PROPYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
573973281
CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)CC4=CC=CC=C4
CCCn1cc(c2c1cccc2)C=C1C(=O)N=C(N(C1=O)Cc1ccccc1)S
InChI=1SC23H21N3O2Sc1212251517(1810671120(18)25)131921(27)2423(29)26(22(19)28)14168435916h3111315H21214H21H3(H242729)b1913+
MFCD05732254
ZINC000005032588
ZINC5032588
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