Vitas-M small molecule compound
(5E)-1-(3,4-dimethylphenyl)-5-{[1-(3,5-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK197687
SMILES Cc1cc(C)cc(c1)n1c(C)cc(c1C)/C=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccc(c(c1)C)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 C33H31N3O2S MW 533.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N3O2S/c1-20-14-21(2)16-29(15-20)34-24(5)18-26(25(34)6)19-30-31(37)35(27-10-8-7-9-11-27)33(39)36(32(30)38)28-13-12-22(3)23(4)17-28/h7-19H,1-6H3/b30-19+InChIKey
AIMLMZAUTHZLCE-NDZAJKAJSA-NSynonyms
(5E)1(34DIMETHYLPHENYL)5((1(35DIMETHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)3PHENYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)1(34DIMETHYLPHENYL)5((1(35DIMETHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)3PHENYL2SULFANYLIDENE13DIAZINANE46DIONE
(E)1(34dimethylphenyl)5((1(35dimethylphenyl)25dimethyl1Hpyrrol3yl)methylene)3phenyl2thioxodihydropyrimidine46(1H5H)dione
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC(=CC(=C4)C)C)C)C(=O)N(C2=S)C5=CC=CC=C5)C
Cc1cc(C)cc(c1)n1c(C)cc(c1C)C=C1C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccc(c(c1)C)C
InChI=1SC33H31N3O2Sc1201421(2)1629(1520)3424(5)1826(25(34)6)193031(37)35(27108791127)33(39)36(32(30)38)28131222(3)23(4)1728h719H16H3b3019+
MFCD02378840
ZINC000002302339
ZINC2302339
Check stock
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Check stock on Vitas-MAvailable files
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