Vitas-M small molecule compound
(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-2-(pyridin-3-ylamino)-1,3-thiazol-4(5H)-one
Catalog ID
STK837477
SMILES O=C1N=C(S/C/1=C/c1ccc2c(c1)OCO2)Nc1cccnc1
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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 C16H11N3O3S MW 325.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N3O3S/c20-15-14(7-10-3-4-12-13(6-10)22-9-21-12)23-16(19-15)18-11-2-1-5-17-8-11/h1-8H,9H2,(H,18,19,20)/b14-7+InChIKey
TWLLNKHRJAYPOS-VGOFMYFVSA-NSynonyms
(5E)5(13benzodioxol5ylmethylidene)2(pyridin3ylamino)13thiazol4(5H)one
(5E)5(13BENZODIOXOL5YLMETHYLIDENE)2(PYRIDIN3YLAMINO)13THIAZOL4ONE
(E)5(benzo(d)(13)dioxol5ylmethylene)2(pyridin3ylamino)thiazol4(5H)one
5(2HBENZO(34D)13DIOXOLAN5YLMETHYLENE)2(3PYRIDYLAMINO)13THIAZOLIN4ONE
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N=C(S3)NC4=CN=CC=C4
InChI=1SC16H11N3O3Sc201514(710341213(610)2292112)2316(1915)181121517811h18H9H2(H181920)b147+
MFCD02994272
O=C1N=C(SC1=Cc1ccc2c(c1)OCO2)Nc1cccnc1
ZINC000004811783
ZINC04811783
ZINC4811783
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