Vitas-M small molecule compound
(5Z)-1-(2-ethylphenyl)-5-[(2-methyl-1,5-diphenyl-1H-pyrrol-3-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK192746
SMILES CCc1ccccc1N1C(=S)NC(=O)/C(=C/c2cc(n(c2C)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 C30H25N3O2S MW 491.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N3O2S/c1-3-21-12-10-11-17-26(21)33-29(35)25(28(34)31-30(33)36)18-23-19-27(22-13-6-4-7-14-22)32(20(23)2)24-15-8-5-9-16-24/h4-19H,3H2,1-2H3,(H,31,34,36)/b25-18-InChIKey
PVTWGBILPOGHOY-BWAHOGKJSA-NSynonyms
(5Z)1(2ETHYLPHENYL)5((2METHYL15DIPHENYL1HPYRROL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)1(2ethylphenyl)5((2methyl15diphenylpyrrol3yl)methylidene)2sulfanylidene13diazinane46dione
CCC1=CC=CC=C1N2C(=O)C(=CC3=C(N(C(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C)C(=O)NC2=S
CCc1ccccc1N1C(=S)NC(=O)C(=Cc2cc(n(c2C)c2ccccc2)c2ccccc2)C1=O
InChI=1SC30H25N3O2Sc13211210111726(21)3329(35)25(28(34)3130(33)36)18231927(22136471422)32(20(23)2)24158591624h419H3H212H3(H313436)b2518
MFCD03227025
ZINC000009311813
ZINC09311813
ZINC9311813
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