Vitas-M small molecule compound
5-{[2,5-dimethyl-1-(naphthalen-2-yl)-1H-pyrrol-3-yl]methylidene}-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187168
SMILES S=C1N(C)C(=O)C(=Cc2cc(n(c2C)c2ccc3c(c2)cccc3)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 C23H21N3O2S MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2S/c1-14-11-18(13-20-21(27)24(3)23(29)25(4)22(20)28)15(2)26(14)19-10-9-16-7-5-6-8-17(16)12-19/h5-13H,1-4H3InChIKey
BXLPIOFHCIVFLX-UHFFFAOYSA-NSynonyms
5((25DIMETHYL1(2NAPHTHYL)1HPYRROL3YL)METHYLENE)13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((25DIMETHYL1(2NAPHTHYL)PYRROL3YL)METHYLENE)13DIMETHYL2THIOXO13DIHYDROPYRIMIDINE46DIONE
5((25DIMETHYL1(NAPHTHALEN2YL)1HPYRROL3YL)METHYLIDENE)13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((25DIMETHYL1NAPHTHALEN2YLPYRROL3YL)METHYLIDENE)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(N1C2=CC3=CC=CC=C3C=C2)C)C=C4C(=O)N(C(=S)N(C4=O)C)C
InChI=1SC23H21N3O2Sc1141118(132021(27)24(3)23(29)25(4)22(20)28)15(2)26(14)1910916756817(16)1219h513H14H3
MFCD02779417
ZINC000000631977
ZINC00631977
ZINC631977
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