Vitas-M small molecule compound

(5Z)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1-(2-chlorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STL149444
SMILES O=C1N=C(S)N(C(=O)/C/1=C\c1cn(c2c1cccc2)Cc1ccccc1)c1ccccc1Cl

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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 C26H18ClN3O2S MW 471.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18ClN3O2S/c27-21-11-5-7-13-23(21)30-25(32)20(24(31)28-26(30)33)14-18-16-29(15-17-8-2-1-3-9-17)22-12-6-4-10-19(18)22/h1-14,16H,15H2,(H,28,31,33)/b20-14-
InChIKey
BKGKIRLLGUPIKQ-ZHZULCJRSA-N
Synonyms
372498-44-7
(5Z)5((1benzyl1Hindol3yl)methylidene)1(2chlorophenyl)2sulfanylpyrimidine46(1H5H)dione
(5Z)5((1BENZYLINDOL3YL)METHYLIDENE)1(2CHLOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
372498447
InChI=1SC26H18ClN3O2Sc272111571323(21)3025(32)20(24(31)2826(30)33)14181629(15178213917)2212641019(18)22h11416H15H2(H283133)b2014
MFCD03816058
O=C1N=C(S)N(C(=O)C1=Cc1cn(c2c1cccc2)Cc1ccccc1)c1ccccc1Cl
ZINC000002277347
ZINC2277347

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Available files

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