Vitas-M small molecule compound
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(4-fluorophenyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL054093
SMILES Fc1ccc(cc1)N/C=C\1/C(=O)N=C(N(C1=O)CCC1=CCCCC1)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 C19H20FN3O2S MW 373.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20FN3O2S/c20-14-6-8-15(9-7-14)21-12-16-17(24)22-19(26)23(18(16)25)11-10-13-4-2-1-3-5-13/h4,6-9,12,21H,1-3,5,10-11H2,(H,22,24,26)/b16-12-InChIKey
VVXNXZKRPGFJGL-VBKFSLOCSA-NSynonyms
(5Z)1(2(cyclohex1en1yl)ethyl)5(((4fluorophenyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5Z)1(2(CYCLOHEXEN1YL)ETHYL)5((4FLUOROANILINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
C1CCC(=CC1)CCN2C(=O)C(=CNC3=CC=C(C=C3)F)C(=O)NC2=S
Fc1ccc(cc1)NC=C1C(=O)N=C(N(C1=O)CCC1=CCCCC1)S
InChI=1SC19H20FN3O2Sc20146815(9714)21121617(24)2219(26)23(18(16)25)1110134213513h4691221H1351011H2(H222426)b1612
MFCD05733269
ZINC000005100554
ZINC05100554
ZINC5100554
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