Vitas-M small molecule compound

(5Z)-1-(4-bromo-2-methylphenyl)-5-[(3-methylthiophen-2-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK197097
SMILES Brc1ccc(c(c1)C)N1C(=S)NC(=O)/C(=C/c2sccc2C)/C1=O

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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 C17H13BrN2O2S2 MW 421.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrN2O2S2/c1-9-5-6-24-14(9)8-12-15(21)19-17(23)20(16(12)22)13-4-3-11(18)7-10(13)2/h3-8H,1-2H3,(H,19,21,23)/b12-8-
InChIKey
JLNPOBNXLAERPD-WQLSENKSSA-N
Synonyms

(5Z)1(4BROMO2METHYLPHENYL)5((3METHYLTHIOPHEN2YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(4BROMO2METHYLPHENYL)5((3METHYLTHIOPHEN2YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
Brc1ccc(c(c1)C)N1C(=S)NC(=O)C(=Cc2sccc2C)C1=O
CC1=C(SC=C1)C=C2C(=O)NC(=S)N(C2=O)C3=C(C=C(C=C3)Br)C
InChI=1SC17H13BrN2O2S2c19562414(9)81215(21)1917(23)20(16(12)22)134311(18)710(13)2h38H12H3(H192123)b128
MFCD04505160
ZINC000012363690
ZINC12363690

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Available files

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