Vitas-M small molecule compound
(5Z)-1-[4-(propan-2-yl)phenyl]-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL055347
SMILES SC1=NC(=O)/C(=C/c2ccc[nH]2)/C(=O)N1c1ccc(cc1)C(C)C
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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 C18H17N3O2S MW 339.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O2S/c1-11(2)12-5-7-14(8-6-12)21-17(23)15(16(22)20-18(21)24)10-13-4-3-9-19-13/h3-11,19H,1-2H3,(H,20,22,24)/b15-10-InChIKey
AENUYTORYANROM-GDNBJRDFSA-NSynonyms
(5Z)1(4(propan2yl)phenyl)5(1Hpyrrol2ylmethylidene)2sulfanylpyrimidine46(1H5H)dione
(5Z)1(4PROPAN2YLPHENYL)5(1HPYRROL2YLMETHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CC(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CN3)C(=O)NC2=S
InChI=1SC18H17N3O2Sc111(2)125714(8612)2117(23)15(16(22)2018(21)24)10134391913h31119H12H3(H202224)b1510
MFCD05727022
SC1=NC(=O)C(=Cc2ccc(nH)2)C(=O)N1c1ccc(cc1)C(C)C
ZINC000057462901
ZINC57462901
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