Vitas-M small molecule compound
(5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-1-butyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL038077
SMILES CCCCN1C(=NC(=O)/C(=C/NCc2ccc3c(c2)OCO3)/C1=O)S
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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 C17H19N3O4S MW 361.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O4S/c1-2-3-6-20-16(22)12(15(21)19-17(20)25)9-18-8-11-4-5-13-14(7-11)24-10-23-13/h4-5,7,9,18H,2-3,6,8,10H2,1H3,(H,19,21,25)/b12-9-InChIKey
LPCPLSVLGAYGMA-XFXZXTDPSA-NSynonyms
(5Z)5(((13benzodioxol5ylmethyl)amino)methylidene)1butyl2sulfanylpyrimidine46(1H5H)dione
(5Z)5((13BENZODIOXOL5YLMETHYLAMINO)METHYLIDENE)1BUTYL2SULFANYLIDENE13DIAZINANE46DIONE
CCCCN1C(=NC(=O)C(=CNCc2ccc3c(c2)OCO3)C1=O)S
CCCCN1C(=O)C(=CNCC2=CC3=C(C=C2)OCO3)C(=O)NC1=S
InChI=1SC17H19N3O4Sc12362016(22)12(15(21)1917(20)25)918811451314(711)24102313h457918H236810H21H3(H192125)b129
MFCD04073016
ZINC000005883556
ZINC5883556
Check stock
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