Vitas-M small molecule compound

(5E)-5-(4-butoxybenzylidene)-2-(2,4-dichlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK797080
SMILES CCCCOc1ccc(cc1)/C=c\1/sc2n(c1=O)nc(n2)c1ccc(cc1Cl)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 C21H17Cl2N3O2S MW 446.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2N3O2S/c1-2-3-10-28-15-7-4-13(5-8-15)11-18-20(27)26-21(29-18)24-19(25-26)16-9-6-14(22)12-17(16)23/h4-9,11-12H,2-3,10H2,1H3/b18-11+
InChIKey
DWEZGLCCKZKEIN-WOJGMQOQSA-N
Synonyms

(5E)5((4BUTOXYPHENYL)METHYLIDENE)2(24DICHLOROPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(4butoxybenzylidene)2(24dichlorophenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(E)5(4butoxybenzylidene)2(24dichlorophenyl)thiazolo(32b)(124)triazol6(5H)one
5((4BUTOXYPHENYL)METHYLIDENE)2(24DICHLOROPHENYL)5H6H(124)TRIAZOLO(32B)(13)THIAZOL6ONE
CCCCOC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=C(C=C(C=C4)Cl)Cl)S2
CCCCOc1ccc(cc1)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1Cl)Cl
InChI=1SC21H17Cl2N3O2Sc1231028157413(5815)111820(27)2621(2918)2419(2526)169614(22)1217(16)23h491112H2310H21H3b1811+
MFCD02995718
ZINC000013810056
ZINC13810056

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Available files

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