Vitas-M small molecule compound

(5Z)-5-[3-methoxy-4-(pentyloxy)benzylidene]-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK799762
SMILES CCCCCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)nc(n2)c1cc(OC)c(c(c1)OC)OC

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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 C26H29N3O6S MW 511.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O6S/c1-6-7-8-11-35-18-10-9-16(12-19(18)31-2)13-22-25(30)29-26(36-22)27-24(28-29)17-14-20(32-3)23(34-5)21(15-17)33-4/h9-10,12-15H,6-8,11H2,1-5H3/b22-13-
InChIKey
WSFBNDGDKQDKDQ-XKZIYDEJSA-N
Synonyms
578743-47-2
(5Z)5((3METHOXY4PENTOXYPHENYL)METHYLIDENE)2(345TRIMETHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(3methoxy4(pentyloxy)benzylidene)2(345trimethoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(3methoxy4(pentyloxy)benzylidene)2(345trimethoxyphenyl)thiazolo(32b)(124)triazol6(5H)one
578743472
CCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC(=C(C(=C4)OC)OC)OC)S2)OC
CCCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(n2)c1cc(OC)c(c(c1)OC)OC
InChI=1SC26H29N3O6Sc167811351810916(1219(18)312)132225(30)2926(3622)2724(2829)171420(323)23(345)21(1517)334h9101215H6811H215H3b2213
MFCD04023950
ZINC000013748877
ZINC13748877

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Available files

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