Vitas-M small molecule compound
(4Z)-2-(methylsulfanyl)-4-(5-nitro-2-propoxybenzylidene)-1,3-thiazol-5(4H)-one
Catalog ID
STK521440
SMILES CCCOc1ccc(cc1/C=C/1\N=C(SC1=O)SC)[N+](=O)[O-]
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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 C14H14N2O4S2 MW 338.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N2O4S2/c1-3-6-20-12-5-4-10(16(18)19)7-9(12)8-11-13(17)22-14(15-11)21-2/h4-5,7-8H,3,6H2,1-2H3/b11-8-InChIKey
QHRLMGZJGGTMBI-FLIBITNWSA-NSynonyms
(4Z)2(methylsulfanyl)4(5nitro2propoxybenzylidene)13thiazol5(4H)one
(4Z)2METHYLSULFANYL4((5NITRO2PROPOXYPHENYL)METHYLIDENE)13THIAZOL5ONE
CCCOC1=C(C=C(C=C1)(N+)(=O)(O))C=C2C(=O)SC(=N2)SC
CCCOc1ccc(cc1C=C1N=C(SC1=O)SC)(N+)(=O)(O)
InChI=1SC14H14N2O4S2c13620125410(16(18)19)79(12)81113(17)2214(1511)212h4578H36H212H3b118
MFCD02376617
ZINC000002882632
ZINC02882632
ZINC2882632
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