Vitas-M small molecule compound
(5E)-1-(4-chlorophenyl)-2-thioxo-5-[(1,2,5-triphenyl-1H-pyrrol-3-yl)methylidene]dihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK191785
SMILES Clc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2cc(n(c2c2ccccc2)c2ccccc2)c2ccccc2)/C1=O
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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 C33H22ClN3O2S MW 560.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H22ClN3O2S/c34-25-16-18-27(19-17-25)37-32(39)28(31(38)35-33(37)40)20-24-21-29(22-10-4-1-5-11-22)36(26-14-8-3-9-15-26)30(24)23-12-6-2-7-13-23/h1-21H,(H,35,38,40)/b28-20+InChIKey
FGHQQNJVUWGHMM-VFCFBJKWSA-NSynonyms
(5E)1(4CHLOROPHENYL)2SULFANYLIDENE5((125TRIPHENYLPYRROL3YL)METHYLIDENE)13DIAZINANE46DIONE
(5E)1(4CHLOROPHENYL)2THIOXO5((125TRIPHENYL1HPYRROL3YL)METHYLIDENE)DIHYDROPYRIMIDINE46(1H5H)DIONE
1(4CHLOROPHENYL)2THIOXO5((125TRIPHENYL1HPYRROL3YL)METHYLENE)DIHYDRO46(1H5H)PYRIMIDINEDIONE
C1=CC=C(C=C1)C2=CC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C=C5C(=O)NC(=S)N(C5=O)C6=CC=C(C=C6)Cl
Clc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2cc(n(c2c2ccccc2)c2ccccc2)c2ccccc2)C1=O
InChI=1SC33H22ClN3O2Sc3425161827(191725)3732(39)28(31(38)3533(37)40)20242129(22104151122)36(26148391526)30(24)23126271323h121H(H353840)b2820+
MFCD01832768
ZINC000008454076
ZINC08454076
ZINC8454076
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.