Vitas-M small molecule compound

5-{[1-(3-chloro-4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK187185
SMILES S=C1N(C)C(=O)C(=Cc2cc(n(c2C)c2ccc(c(c2)Cl)F)C)C(=O)N1C

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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 C19H17ClFN3O2S MW 405.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClFN3O2S/c1-10-7-12(8-14-17(25)22(3)19(27)23(4)18(14)26)11(2)24(10)13-5-6-16(21)15(20)9-13/h5-9H,1-4H3
InChIKey
QYTDFKQUZURJEP-UHFFFAOYSA-N
Synonyms

5((1(3CHLORO4FLUOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((1(3CHLORO4FLUOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(N1C2=CC(=C(C=C2)F)Cl)C)C=C3C(=O)N(C(=S)N(C3=O)C)C
InChI=1SC19H17ClFN3O2Sc110712(81417(25)22(3)19(27)23(4)18(14)26)11(2)24(10)135616(21)15(20)913h59H14H3
MFCD02779773
ZINC000003220635
ZINC03220635
ZINC3220635

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Available files

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