Vitas-M small molecule compound

(5Z)-2-(4-tert-butylphenyl)-5-(3-ethoxy-4-propoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK903557
SMILES CCCOc1ccc(cc1OCC)/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)C(C)(C)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 C26H29N3O3S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O3S/c1-6-14-32-20-13-8-17(15-21(20)31-7-2)16-22-24(30)29-25(33-22)27-23(28-29)18-9-11-19(12-10-18)26(3,4)5/h8-13,15-16H,6-7,14H2,1-5H3/b22-16-
InChIKey
GUDYYZOEVUNKOC-JWGURIENSA-N
Synonyms
617694-43-6
(5Z)2(4TERTBUTYLPHENYL)5((3ETHOXY4PROPOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(4tertbutylphenyl)5(3ethoxy4propoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)2(4(tertbutyl)phenyl)5(3ethoxy4propoxybenzylidene)thiazolo(32b)(124)triazol6(5H)one
2(4(TERTBUTYL)PHENYL)5(3ETHOXY4PROPOXYBENZYLIDENE)THIAZOLO(32B)(124)TRIAZOL6(5H)ONE
617694436
CCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)C(C)(C)C)S2)OCC
CCCOc1ccc(cc1OCC)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)C(C)(C)C
InChI=1SC26H29N3O3Sc1614322013817(1521(20)3172)162224(30)2925(3322)2723(2829)1891119(121018)26(34)5h8131516H6714H215H3b2216
MFCD03666951
ZINC000013646555
ZINC13646555

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Available files

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