Vitas-M small molecule compound
(5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-1-cyclopropyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL147677
SMILES O=C1N=C(S)N(C(=O)/C/1=C\NCc1ccc2c(c1)OCO2)C1CC1
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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 C16H15N3O4S MW 345.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O4S/c20-14-11(15(21)19(10-2-3-10)16(24)18-14)7-17-6-9-1-4-12-13(5-9)23-8-22-12/h1,4-5,7,10,17H,2-3,6,8H2,(H,18,20,24)/b11-7-InChIKey
VKSKXBMKYKERPF-XFFZJAGNSA-NSynonyms
(5Z)5(((13benzodioxol5ylmethyl)amino)methylidene)1cyclopropyl2sulfanylpyrimidine46(1H5H)dione
(5Z)5((13BENZODIOXOL5YLMETHYLAMINO)METHYLIDENE)1CYCLOPROPYL2SULFANYLIDENE13DIAZINANE46DIONE
C1CC1N2C(=O)C(=CNCC3=CC4=C(C=C3)OCO4)C(=O)NC2=S
InChI=1SC16H15N3O4Sc201411(15(21)19(102310)16(24)1814)71769141213(59)2382212h14571017H2368H2(H182024)b117
MFCD04071699
O=C1N=C(S)N(C(=O)C1=CNCc1ccc2c(c1)OCO2)C1CC1
ZINC000002589468
ZINC2589468
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