Vitas-M small molecule compound
(5Z)-5-[3-methoxy-4-(pentyloxy)benzylidene]-2-[4-(prop-2-en-1-yloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK817871
SMILES CCCCCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)OCC=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 C26H27N3O4S MW 477.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O4S/c1-4-6-7-15-33-21-13-8-18(16-22(21)31-3)17-23-25(30)29-26(34-23)27-24(28-29)19-9-11-20(12-10-19)32-14-5-2/h5,8-13,16-17H,2,4,6-7,14-15H2,1,3H3/b23-17-InChIKey
GSZPIPREFGBNRW-QJOMJCCJSA-NSynonyms
(5Z)5((3METHOXY4PENTOXYPHENYL)METHYLIDENE)2(4PROP2ENOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(3methoxy4(pentyloxy)benzylidene)2(4(prop2en1yloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCC=C)S2)OC
CCCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)OCC=C
InChI=1SC26H27N3O4Sc146715332113818(1622(21)313)172325(30)2926(3423)2724(2829)1991120(121019)321452h58131617H24671415H213H3b2317
MFCD06643023
ZINC000016736619
ZINC16736619
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