Vitas-M small molecule compound

(5E)-1-(2,3-dichlorophenyl)-5-{[(4-methoxyphenyl)amino]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STL371772
SMILES COc1ccc(cc1)N/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl

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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 C18H13Cl2N3O3S MW 422.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13Cl2N3O3S/c1-26-11-7-5-10(6-8-11)21-9-12-16(24)22-18(27)23(17(12)25)14-4-2-3-13(19)15(14)20/h2-9,21H,1H3,(H,22,24,27)/b12-9+
InChIKey
HWGKVDUGOZJKGQ-FMIVXFBMSA-N
Synonyms

(5E)1(23dichlorophenyl)5(((4methoxyphenyl)amino)methylidene)2thioxodihydropyrimidine46(1H5H)dione
(5E)1(23DICHLOROPHENYL)5((4METHOXYANILINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
COC1=CC=C(C=C1)NC=C2C(=O)NC(=S)N(C2=O)C3=C(C(=CC=C3)Cl)Cl
COc1ccc(cc1)NC=C1C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
InChI=1SC18H13Cl2N3O3Sc126117510(6811)2191216(24)2218(27)23(17(12)25)1442313(19)15(14)20h2921H1H3(H222427)b129+
MFCD03272264
ZINC000003004694
ZINC03004694
ZINC3004694

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Available files

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