Vitas-M small molecule compound

(5Z)-1-(3-chlorophenyl)-5-[(1-methyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STK565625
SMILES Clc1cccc(c1)N1C(=NC(=O)/C(=C/c2cn(c3c2cccc3)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 C20H14ClN3O2S MW 395.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClN3O2S/c1-23-11-12(15-7-2-3-8-17(15)23)9-16-18(25)22-20(27)24(19(16)26)14-6-4-5-13(21)10-14/h2-11H,1H3,(H,22,25,27)/b16-9-
InChIKey
CTMOKYHOAXVVHA-SXGWCWSVSA-N
Synonyms
374549-07-2
(5Z)1(3chlorophenyl)5((1methyl1Hindol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5Z)1(3CHLOROPHENYL)5((1METHYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
374549072
Clc1cccc(c1)N1C(=NC(=O)C(=Cc2cn(c3c2cccc3)C)C1=O)S
CN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC(=CC=C4)Cl
InChI=1SC20H14ClN3O2Sc1231112(15723817(15)23)91618(25)2220(27)24(19(16)26)1464513(21)1014h211H1H3(H222527)b169
MFCD03806626
ZINC000004817141
ZINC04817141
ZINC4817141

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Available files

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