Vitas-M small molecule compound

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

Catalog ID
STK031639
SMILES CCOc1ccc2c(c1)/C(=c\1/sc3=NCN(Cn3c1=O)c1ccc(c(c1)Cl)C)/C(=O)N2

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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 C22H19ClN4O3S MW 454.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O3S/c1-3-30-14-6-7-17-15(9-14)18(20(28)25-17)19-21(29)27-11-26(10-24-22(27)31-19)13-5-4-12(2)16(23)8-13/h4-9H,3,10-11H2,1-2H3,(H,25,28)/b19-18-
InChIKey
PPEDWPWIWZPLSE-HNENSFHCSA-N
Synonyms
732248-33-8
(7Z)3(3CHLORO4METHYLPHENYL)7(5ETHOXY2OXO12DIHYDRO3HINDOL3YLIDENE)34DIHYDRO2H(13)THIAZOLO(32A)(135)TRIAZIN6(7H)ONE
(7Z)3(3CHLORO4METHYLPHENYL)7(5ETHOXY2OXO1HINDOL3YLIDENE)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(Z)3(3chloro4methylphenyl)7(5ethoxy2oxoindolin3ylidene)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
732248338
CCOC1=CC2=C(C=C1)NC(=O)C2=C3C(=O)N4CN(CN=C4S3)C5=CC(=C(C=C5)C)Cl
CCOc1ccc2c(c1)C(=c1sc3=NCN(Cn3c1=O)c1ccc(c(c1)Cl)C)C(=O)N2
InChI=1SC22H19ClN4O3Sc133014671715(914)18(20(28)2517)1921(29)271126(102422(27)3119)135412(2)16(23)813h49H31011H212H3(H2528)b1918
MFCD03677880
STK031639
ZINC000002222044
ZINC02222044
ZINC2222044

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Available files

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