Vitas-M small molecule compound
(2E)-5-ethoxy-2-[(heptylamino)methylidene]-1-benzothiophen-3(2H)-one
Catalog ID
STK674247
SMILES CCCCCCCN/C=C\1/Sc2c(C1=O)cc(cc2)OCC
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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 C18H25NO2S MW 319.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25NO2S/c1-3-5-6-7-8-11-19-13-17-18(20)15-12-14(21-4-2)9-10-16(15)22-17/h9-10,12-13,19H,3-8,11H2,1-2H3/b17-13+InChIKey
BQDLXCHJJOQCDY-GHRIWEEISA-NSynonyms
(2E)5ETHOXY2((HEPTYLAMINO)METHYLIDENE)1BENZOTHIOPHEN3(2H)ONE
(2E)5ETHOXY2((HEPTYLAMINO)METHYLIDENE)1BENZOTHIOPHEN3ONE
5ETHOXY2((HEPTYLAMINO)METHYLENE)BENZO(B)THIOPHEN3ONE
CCCCCCCNC=C1C(=O)C2=C(S1)C=CC(=C2)OCC
CCCCCCCNC=C1Sc2c(C1=O)cc(cc2)OCC
InChI=1SC18H25NO2Sc1356781119131718(20)151214(2142)91016(15)2217h910121319H3811H212H3b1713+
MFCD01305127
ZINC000100066133
ZINC100066133
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