Vitas-M small molecule compound

(5Z)-5-[4-(propan-2-yl)benzylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK798313
SMILES CCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1ccc(cc1)C(C)C)/c2=O

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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 C23H23N3O2S MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O2S/c1-4-13-28-19-11-9-18(10-12-19)21-24-23-26(25-21)22(27)20(29-23)14-16-5-7-17(8-6-16)15(2)3/h5-12,14-15H,4,13H2,1-3H3/b20-14-
InChIKey
GWMVOEUFJVMIQI-ZHZULCJRSA-N
Synonyms
371136-75-3
(5Z)5((4PROPAN2YLPHENYL)METHYLIDENE)2(4PROPOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(4(propan2yl)benzylidene)2(4propoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(4isopropylbenzylidene)2(4propoxyphenyl)thiazolo(32b)(124)triazol6(5H)one
371136753
CCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(C=C4)C(C)C)SC3=N2
CCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(cc1)C(C)C)c2=O
InChI=1SC23H23N3O2Sc1413281911918(101219)21242326(2521)22(27)20(2923)14165717(8616)15(2)3h5121415H413H213H3b2014
MFCD03008744
ZINC000001781100
ZINC01781100
ZINC1781100

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Available files

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