Vitas-M small molecule compound
(5E)-1-ethyl-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL046277
SMILES CCN1C(=NC(=O)/C(=C\NCCN2CCNCC2)/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 C13H21N5O2S MW 311.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H21N5O2S/c1-2-18-12(20)10(11(19)16-13(18)21)9-15-5-8-17-6-3-14-4-7-17/h9,14-15H,2-8H2,1H3,(H,16,19,21)/b10-9+InChIKey
BCZAIIOCIYFSQD-MDZDMXLPSA-NSynonyms
(5E)1ethyl5(((2(piperazin1yl)ethyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1ETHYL5((2PIPERAZIN1YLETHYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CCN1C(=NC(=O)C(=CNCCN2CCNCC2)C1=O)S
CCN1C(=O)C(=CNCCN2CCNCC2)C(=O)NC1=S
InChI=1SC13H21N5O2Sc121812(20)10(11(19)1613(18)21)915581763144717h91415H28H21H3(H161921)b109+
MFCD03795838
ZINC000019995860
ZINC000103110688
ZINC19995860
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