Vitas-M small molecule compound

(7Z)-7-(5-chloro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one

Catalog ID
STK859967
SMILES COc1cc(cc(c1OC)OC)N1CN=c2n(C1)c(=O)/c(=C\1/C(=O)Nc3c1cc(Cl)cc3)/s2

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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 C22H19ClN4O5S MW 486.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O5S/c1-30-15-7-12(8-16(31-2)18(15)32-3)26-9-24-22-27(10-26)21(29)19(33-22)17-13-6-11(23)4-5-14(13)25-20(17)28/h4-8H,9-10H2,1-3H3,(H,25,28)/b19-17-
InChIKey
LWSAJOZDVWXZQY-ZPHPHTNESA-N
Synonyms
488707-75-1
(7Z)7(5chloro2oxo12dihydro3Hindol3ylidene)3(345trimethoxyphenyl)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(7Z)7(5CHLORO2OXO1HINDOL3YLIDENE)3(345TRIMETHOXYPHENYL)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(Z)7(5chloro2oxoindolin3ylidene)3(345trimethoxyphenyl)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
488707751
COC1=CC(=CC(=C1OC)OC)N2CN=C3N(C2)C(=O)C(=C4C5=C(C=CC(=C5)Cl)NC4=O)S3
COc1cc(cc(c1OC)OC)N1CN=c2n(C1)c(=O)c(=C1C(=O)Nc3c1cc(Cl)cc3)s2
InChI=1SC22H19ClN4O5Sc13015712(816(312)18(15)323)269242227(1026)21(29)19(3322)1713611(23)4514(13)2520(17)28h48H910H213H3(H2528)b1917
MFCD03290644
ZINC000002335660
ZINC02335660
ZINC2335660

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Available files

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