Vitas-M small molecule compound
5-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}methylidene)-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL375920
SMILES O=C(N1CCCCCC1)Cn1cc(c2c1cccc2)C=C1C(=O)N(C)C(=S)N(C1=O)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 C23H26N4O3S MW 438.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O3S/c1-24-21(29)18(22(30)25(2)23(24)31)13-16-14-27(19-10-6-5-9-17(16)19)15-20(28)26-11-7-3-4-8-12-26/h5-6,9-10,13-14H,3-4,7-8,11-12,15H2,1-2H3InChIKey
BWDNOGMRBJJQIS-UHFFFAOYSA-NSynonyms
5((1(2(azepan1yl)2oxoethyl)1Hindol3yl)methylidene)13dimethyl2thioxodihydropyrimidine46(1H5H)dione
5((1(2(azepan1yl)2oxoethyl)indol3yl)methylidene)13dimethyl2sulfanylidene13diazinane46dione
CN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)N4CCCCCC4)C(=O)N(C1=S)C
InChI=1SC23H26N4O3Sc12421(29)18(22(30)25(2)23(24)31)13161427(191065917(16)19)1520(28)261173481226h569101314H3478111215H212H3
MFCD04236462
ZINC000059087213
ZINC59087213
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