Vitas-M small molecule compound
(2E)-5-ethoxy-2-{[(pyridin-4-ylmethyl)amino]methylidene}-1-benzothiophen-3(2H)-one
Catalog ID
STL446384
SMILES CCOc1ccc2c(c1)C(=O)/C(=C\NCc1ccncc1)/S2
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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 C17H16N2O2S MW 312.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O2S/c1-2-21-13-3-4-15-14(9-13)17(20)16(22-15)11-19-10-12-5-7-18-8-6-12/h3-9,11,19H,2,10H2,1H3/b16-11+InChIKey
SIRQGHGFJXUSLL-LFIBNONCSA-NSynonyms
(2E)5ethoxy2(((pyridin4ylmethyl)amino)methylidene)1benzothiophen3(2H)one
(2E)5ETHOXY2((PYRIDIN4YLMETHYLAMINO)METHYLIDENE)1BENZOTHIOPHEN3ONE
CCOC1=CC2=C(C=C1)SC(=CNCC3=CC=NC=C3)C2=O
CCOc1ccc2c(c1)C(=O)C(=CNCc1ccncc1)S2
InChI=1SC17H16N2O2Sc122113341514(913)17(20)16(2215)1119101257188612h391119H210H21H3b1611+
MFCD01304696
ZINC000101390281
ZINC101390281
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