Vitas-M small molecule compound
(5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-4,6(1H,5H)-dione
Catalog ID
STL053582
SMILES SC1=NC(=O)/C(=C\NCC2CCCO2)/C(=O)N1CCC1=CCCCC1
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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 C18H25N3O3S MW 363.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3O3S/c22-16-15(12-19-11-14-7-4-10-24-14)17(23)21(18(25)20-16)9-8-13-5-2-1-3-6-13/h5,12,14,19H,1-4,6-11H2,(H,20,22,25)/b15-12+InChIKey
YAUIFUICTGCVFB-NTCAYCPXSA-NSynonyms
(5E)1(2(cyclohex1en1yl)ethyl)2sulfanyl5(((tetrahydrofuran2ylmethyl)amino)methylidene)pyrimidine46(1H5H)dione
(5E)1(2(CYCLOHEXEN1YL)ETHYL)5((OXOLAN2YLMETHYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
C1CCC(=CC1)CCN2C(=O)C(=CNCC3CCCO3)C(=O)NC2=S
InChI=1SC18H25N3O3Sc221615(1219111474102414)17(23)21(18(25)2016)98135213613h5121419H14611H2(H202225)b1512+
MFCD05735814
ZINC000005624750
ZINC000005624751
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