Vitas-M small molecule compound
(5E)-1-(4-chlorophenyl)-5-[(5-methylthiophen-2-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK563122
SMILES Clc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(s2)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 C16H11ClN2O2S2 MW 362.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN2O2S2/c1-9-2-7-12(23-9)8-13-14(20)18-16(22)19(15(13)21)11-5-3-10(17)4-6-11/h2-8H,1H3,(H,18,20,22)/b13-8+InChIKey
BMYMVIVQKFBRAQ-MDWZMJQESA-NSynonyms
(5E)1(4CHLOROPHENYL)5((5METHYLTHIOPHEN2YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(4chlorophenyl)5((5methylthiophen2yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
CC1=CC=C(S1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Cl
Clc1ccc(cc1)N1C(=NC(=O)C(=Cc2ccc(s2)C)C1=O)S
InChI=1SC16H11ClN2O2S2c192712(239)81314(20)1816(22)19(15(13)21)115310(17)4611h28H1H3(H182022)b138+
MFCD03802086
ZINC000017124878
ZINC17124878
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