Vitas-M small molecule compound
(5E)-5-({[2-(4-acetylpiperazin-1-yl)ethyl]amino}methylidene)-1-(4-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL043780
SMILES Fc1ccc(cc1)N1C(=NC(=O)/C(=C\NCCN2CCN(CC2)C(=O)C)/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 C19H22FN5O3S MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22FN5O3S/c1-13(26)24-10-8-23(9-11-24)7-6-21-12-16-17(27)22-19(29)25(18(16)28)15-4-2-14(20)3-5-15/h2-5,12,21H,6-11H2,1H3,(H,22,27,29)/b16-12+InChIKey
SAJFDIKLMXIWCK-FOWTUZBSSA-NSynonyms
5287-13-8(5E)5(((2(4acetylpiperazin1yl)ethyl)amino)methylidene)1(4fluorophenyl)2sulfanylpyrimidine46(1H5H)dione
(5E)5((2(4ACETYLPIPERAZIN1YL)ETHYLAMINO)METHYLIDENE)1(4FLUOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
5287138
BENZENESULFONAMIDEN(CYCLOHEXYLCARBONIMIDOYL)4METHYL
CC(=O)N1CCN(CC1)CCNC=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)F
Fc1ccc(cc1)N1C(=NC(=O)C(=CNCCN2CCN(CC2)C(=O)C)C1=O)S
InChI=1SC19H22FN5O3Sc113(26)2410823(91124)7621121617(27)2219(29)25(18(16)28)154214(20)3515h251221H611H21H3(H222729)b1612+
MFCD04072253
ZINC000002591075
ZINC02591075
ZINC2591075
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