Vitas-M small molecule compound

(7Z)-3-(3-acetylphenyl)-7-(4-chlorobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one

Catalog ID
STK076810
SMILES Clc1ccc(cc1)/C=c/1\sc2=NCN(Cn2c1=O)c1cccc(c1)C(=O)C

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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 C20H16ClN3O2S MW 397.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN3O2S/c1-13(25)15-3-2-4-17(10-15)23-11-22-20-24(12-23)19(26)18(27-20)9-14-5-7-16(21)8-6-14/h2-10H,11-12H2,1H3/b18-9-
InChIKey
PCMWZWSLEISSQR-NVMNQCDNSA-N
Synonyms
733801-27-9
(7Z)3(3ACETYLPHENYL)7((4CHLOROPHENYL)METHYLIDENE)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(7Z)3(3ACETYLPHENYL)7(4CHLOROBENZYLIDENE)34DIHYDRO2H(13)THIAZOLO(32A)(135)TRIAZIN6(7H)ONE
(Z)3(3acetylphenyl)7(4chlorobenzylidene)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
733801279
CC(=O)C1=CC(=CC=C1)N2CN=C3N(C2)C(=O)C(=CC4=CC=C(C=C4)Cl)S3
Clc1ccc(cc1)C=c1sc2=NCN(Cn2c1=O)c1cccc(c1)C(=O)C
InChI=1SC20H16ClN3O2Sc113(25)1532417(1015)2311222024(1223)19(26)18(2720)9145716(21)8614h210H1112H21H3b189
MFCD03682402
STK076810
ZINC000002236460
ZINC02236460
ZINC2236460

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Available files

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