Vitas-M small molecule compound
(5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-(naphthalen-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL051173
SMILES O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCN2Cc1ccccc1Cl)c1cccc2c1cccc2
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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 C30H22ClN3O2S MW 524.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22ClN3O2S/c31-25-10-4-2-7-22(25)18-33-15-14-21-16-19(12-13-26(21)33)17-24-28(35)32-30(37)34(29(24)36)27-11-5-8-20-6-1-3-9-23(20)27/h1-13,16-17H,14-15,18H2,(H,32,35,37)/b24-17+InChIKey
HKPDAINRBLEGBF-JJIBRWJFSA-NSynonyms
578735-70-3(5E)5((1((2CHLOROPHENYL)METHYL)23DIHYDROINDOL5YL)METHYLIDENE)1NAPHTHALEN1YL2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((1(2chlorobenzyl)23dihydro1Hindol5yl)methylidene)1(naphthalen1yl)2sulfanylpyrimidine46(1H5H)dione
578735703
C1CN(C2=C1C=C(C=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC5=CC=CC=C54)CC6=CC=CC=C6Cl
InChI=1SC30H22ClN3O2Sc31251042722(25)18331514211619(121326(21)33)172428(35)3230(37)34(29(24)36)27115820613923(20)27h1131617H141518H2(H323537)b2417+
MFCD05733427
O=C1N=C(S)N(C(=O)C1=Cc1ccc2c(c1)CCN2Cc1ccccc1Cl)c1cccc2c1cccc2
ZINC000002394712
ZINC02394712
ZINC2394712
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