Vitas-M small molecule compound
(5Z)-5-(2-butoxybenzylidene)-2-(3-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800448
SMILES CCCCOc1ccccc1/C=c/1\sc2n(c1=O)nc(n2)c1cccc(c1)Cl
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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 C21H18ClN3O2S MW 411.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O2S/c1-2-3-11-27-17-10-5-4-7-14(17)13-18-20(26)25-21(28-18)23-19(24-25)15-8-6-9-16(22)12-15/h4-10,12-13H,2-3,11H2,1H3/b18-13-InChIKey
ASDUNMREDSLVNU-AQTBWJFISA-NSynonyms
578720-84-0(5Z)5((2BUTOXYPHENYL)METHYLIDENE)2(3CHLOROPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(2butoxybenzylidene)2(3chlorophenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(2butoxybenzylidene)2(3chlorophenyl)thiazolo(32b)(124)triazol6(5H)one
578720840
CCCCOC1=CC=CC=C1C=C2C(=O)N3C(=NC(=N3)C4=CC(=CC=C4)Cl)S2
CCCCOc1ccccc1C=c1sc2n(c1=O)nc(n2)c1cccc(c1)Cl
InChI=1SC21H18ClN3O2Sc1231127171054714(17)131820(26)2521(2818)2319(2425)1586916(22)1215h4101213H2311H21H3b1813
MFCD04029659
ZINC000013750248
ZINC13750248
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