Vitas-M small molecule compound
(5Z)-5-[3-methoxy-4-(octyloxy)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK703564
SMILES CCCCCCCCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)ncn2
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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 C20H25N3O3S MW 387.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S/c1-3-4-5-6-7-8-11-26-16-10-9-15(12-17(16)25-2)13-18-19(24)23-20(27-18)21-14-22-23/h9-10,12-14H,3-8,11H2,1-2H3/b18-13-InChIKey
YGJHKFSHYOLZEQ-AQTBWJFISA-NSynonyms
(5Z)5((3METHOXY4OCTOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(3methoxy4(octyloxy)benzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(3methoxy4(octyloxy)benzylidene)thiazolo(32b)(124)triazol6(5H)one
CCCCCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC=N3)S2)OC
CCCCCCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)ncn2
InChI=1SC20H25N3O3Sc134567811261610915(1217(16)252)131819(24)2320(2718)21142223h9101214H3811H212H3b1813
MFCD03665967
ZINC000100870971
ZINC100870971
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