Vitas-M small molecule compound
(5Z)-5-(3-methoxybenzylidene)-2-[4-(pentyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK817497
SMILES CCCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cccc(c1)OC)/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 C23H23N3O3S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S/c1-3-4-5-13-29-18-11-9-17(10-12-18)21-24-23-26(25-21)22(27)20(30-23)15-16-7-6-8-19(14-16)28-2/h6-12,14-15H,3-5,13H2,1-2H3/b20-15-InChIKey
MSTOKGNECKYTPY-HKWRFOASSA-NSynonyms
(5Z)5((3METHOXYPHENYL)METHYLIDENE)2(4PENTOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(3methoxybenzylidene)2(4(pentyloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC(=CC=C4)OC)SC3=N2
CCCCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1cccc(c1)OC)c2=O
InChI=1SC23H23N3O3Sc134513291811917(101218)21242326(2521)22(27)20(3023)151676819(1416)282h6121415H3513H212H3b2015
MFCD06308809
ZINC000003648989
ZINC03648989
ZINC3648989
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