Vitas-M small molecule compound

(2Z)-2-[3-methoxy-4-(octyloxy)benzylidene]-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK880663
SMILES CCCCCCCCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)nc(c(=O)n2)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 C22H27N3O4S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O4S/c1-4-5-6-7-8-9-12-29-17-11-10-16(13-18(17)28-3)14-19-21(27)25-22(30-19)23-20(26)15(2)24-25/h10-11,13-14H,4-9,12H2,1-3H3/b19-14-
InChIKey
LBZCWZZOYILZGY-RGEXLXHISA-N
Synonyms
617694-34-5
(2Z)2((3METHOXY4OCTOXYPHENYL)METHYLIDENE)6METHYL(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)2(3methoxy4(octyloxy)benzylidene)6methyl7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)2(3methoxy4(octyloxy)benzylidene)6methyl2Hthiazolo(32b)(124)triazine37dione
2(3METHOXY4(OCTYLOXY)BENZYLIDENE)6METHYL2HTHIAZOLO(32B)(124)TRIAZINE37DIONE
617694345
CCCCCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=O)C(=N3)C)S2)OC
CCCCCCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(c(=O)n2)C
InChI=1SC22H27N3O4Sc1456789122917111016(1318(17)283)141921(27)2522(3019)2320(26)15(2)2425h10111314H4912H213H3b1914
MFCD03665064
ZINC000100870975
ZINC100870975

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Available files

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