Vitas-M small molecule compound
(5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(pyridin-3-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL046531
SMILES SC1=NC(=O)/C(=C\NCc2cccnc2)/C(=O)N1CCC1=CCCCC1
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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 C19H22N4O2S MW 370.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O2S/c24-17-16(13-21-12-15-7-4-9-20-11-15)18(25)23(19(26)22-17)10-8-14-5-2-1-3-6-14/h4-5,7,9,11,13,21H,1-3,6,8,10,12H2,(H,22,24,26)/b16-13+InChIKey
GIPWOJMWKWMDPY-DTQAZKPQSA-NSynonyms
(5E)1(2(cyclohex1en1yl)ethyl)5(((pyridin3ylmethyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1(2(CYCLOHEXEN1YL)ETHYL)5((PYRIDIN3YLMETHYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
1(2CYCLOHEX1ENYLETHYL)5(1((PYRIDIN3YLMETHYL)AMINO)METH(E)YLIDENE)2THIOXODIHYDROPYRIMIDINE46DIONE
C1CCC(=CC1)CCN2C(=O)C(=CNCC3=CN=CC=C3)C(=O)NC2=S
InChI=1SC19H22N4O2Sc241716(13211215749201115)18(25)23(19(26)2217)108145213614h4579111321H13681012H2(H222426)b1613+
MFCD04079666
SC1=NC(=O)C(=CNCc2cccnc2)C(=O)N1CCC1=CCCCC1
ZINC000006423852
ZINC06423852
ZINC6423852
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