Vitas-M small molecule compound
(2Z)-5-ethoxy-2-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-1-benzothiophen-3(2H)-one
Catalog ID
STL446502
SMILES CCOc1ccc2c(c1)C(=O)/C(=C/NCCc1c[nH]c3c1cccc3)/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 C21H20N2O2S MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O2S/c1-2-25-15-7-8-19-17(11-15)21(24)20(26-19)13-22-10-9-14-12-23-18-6-4-3-5-16(14)18/h3-8,11-13,22-23H,2,9-10H2,1H3/b20-13-InChIKey
CTJCLEQWLFWVDB-MOSHPQCFSA-NSynonyms
(2Z)5ethoxy2(((2(1Hindol3yl)ethyl)amino)methylidene)1benzothiophen3(2H)one
(2Z)5ethoxy2((2(1Hindol3yl)ethylamino)methylidene)1benzothiophen3one
CCOC1=CC2=C(C=C1)SC(=CNCCC3=CNC4=CC=CC=C43)C2=O
CCOc1ccc2c(c1)C(=O)C(=CNCCc1c(nH)c3c1cccc3)S2
InChI=1SC21H20N2O2Sc122515781917(1115)21(24)20(2619)132210914122318643516(14)18h3811132223H2910H21H3b2013
MFCD30712911
ZINC000101631736
ZINC101631736
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