Vitas-M small molecule compound
(5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-ethyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK561066
SMILES CCN1C(=NC(=O)/C(=C/c2nc3c([nH]2)cccc3)/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 C14H12N4O2S MW 300.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4O2S/c1-2-18-13(20)8(12(19)17-14(18)21)7-11-15-9-5-3-4-6-10(9)16-11/h3-7H,2H2,1H3,(H,15,16)(H,17,19,21)/b8-7-InChIKey
LRLQKYGCWRKJRS-FPLPWBNLSA-NSynonyms
(5Z)5(1HBENZIMIDAZOL2YLMETHYLIDENE)1ETHYL2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)5(1Hbenzimidazol2ylmethylidene)1ethyl2sulfanylpyrimidine46(1H5H)dione
5(1HBENZOIMIDAZOL2YLMETHYLENE)1ETHYL2THIOXODIHYDROPYRIMIDINE46DIONE
CCN1C(=NC(=O)C(=Cc2nc3c((nH)2)cccc3)C1=O)S
CCN1C(=O)C(=CC2=NC3=CC=CC=C3N2)C(=O)NC1=S
InChI=1SC14H12N4O2Sc121813(20)8(12(19)1714(18)21)711159534610(9)1611h37H2H21H3(H1516)(H171921)b87
MFCD03795884
ZINC000006783654
ZINC06783654
ZINC6783654
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