Vitas-M small molecule compound
(5E)-5-[3-methoxy-4-(pentyloxy)benzylidene]-2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK818219
SMILES CCCCCOc1ccc(cc1OC)/C=c\1/sc2n(c1=O)nc(n2)c1cccc(c1)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 C24H25N3O3S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O3S/c1-4-5-6-12-30-19-11-10-17(14-20(19)29-3)15-21-23(28)27-24(31-21)25-22(26-27)18-9-7-8-16(2)13-18/h7-11,13-15H,4-6,12H2,1-3H3/b21-15+InChIKey
YBNUKOADDJJAAV-RCCKNPSSSA-NSynonyms
(5E)5((3METHOXY4PENTOXYPHENYL)METHYLIDENE)2(3METHYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(3methoxy4(pentyloxy)benzylidene)2(3methylphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(3methoxy4(pentyloxy)benzylidene)2(mtolyl)thiazolo(32b)(124)triazol6(5H)one
CCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC(=CC=C4)C)S2)OC
CCCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(n2)c1cccc(c1)C
InChI=1SC24H25N3O3Sc1456123019111017(1420(19)293)152123(28)2724(3121)2522(2627)1897816(2)1318h7111315H4612H213H3b2115+
MFCD06643055
ZINC000026779437
ZINC26779437
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