Vitas-M small molecule compound
(5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK191631
SMILES C=CCN1C(=S)NC(=O)/C(=C/c2cc(n(c2C)c2ccccc2)C)/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 C20H19N3O2S MW 365.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O2S/c1-4-10-22-19(25)17(18(24)21-20(22)26)12-15-11-13(2)23(14(15)3)16-8-6-5-7-9-16/h4-9,11-12H,1,10H2,2-3H3,(H,21,24,26)/b17-12-InChIKey
LBZIHPYGVDXNMB-ATVHPVEESA-NSynonyms
(5Z)5((25DIMETHYL1PHENYL1HPYRROL3YL)METHYLIDENE)1(PROP2EN1YL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)5((25DIMETHYL1PHENYLPYRROL3YL)METHYLIDENE)1PROP2ENYL2SULFANYLIDENE13DIAZINANE46DIONE
(Z)1allyl5((25dimethyl1phenyl1Hpyrrol3yl)methylene)2thioxodihydropyrimidine46(1H5H)dione
1ALLYL5((25DIMETHYL1PHENYL1HPYRROL3YL)METHYLENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3C(=O)NC(=S)N(C3=O)CC=C
InChI=1SC20H19N3O2Sc14102219(25)17(18(24)2120(22)26)12151113(2)23(14(15)3)168657916h491112H110H223H3(H212426)b1712
MFCD02212809
ZINC000000977613
ZINC00977613
ZINC977613
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