Vitas-M small molecule compound

(5Z)-1-(2,3-dichlorophenyl)-5-{[2,5-dimethyl-1-(quinolin-6-yl)-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STK586459
SMILES O=C1N=C(S)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc2c(c1)cccn2)C)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 C26H18Cl2N4O2S MW 521.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18Cl2N4O2S/c1-14-11-17(15(2)31(14)18-8-9-21-16(12-18)5-4-10-29-21)13-19-24(33)30-26(35)32(25(19)34)22-7-3-6-20(27)23(22)28/h3-13H,1-2H3,(H,30,33,35)/b19-13-
InChIKey
SYLPYEKJSSSLQI-UYRXBGFRSA-N
Synonyms
471276-98-9
(5Z)1(23dichlorophenyl)5((25dimethyl1(quinolin6yl)1Hpyrrol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5Z)1(23dichlorophenyl)5((25dimethyl1quinolin6ylpyrrol3yl)methylidene)2sulfanylidene13diazinane46dione
471276989
InChI=1SC26H18Cl2N4O2Sc1141117(15(2)31(14)18892116(1218)54102921)131924(33)3026(35)32(25(19)34)2273620(27)23(22)28h313H12H3(H303335)b1913
MFCD07205567
O=C1N=C(S)N(C(=O)C1=Cc1cc(n(c1C)c1ccc2c(c1)cccn2)C)c1cccc(c1Cl)Cl
ZINC000097968119
ZINC97968119

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Available files

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