Vitas-M small molecule compound
ethyl 2-[(5-chloro-2-hydroxybenzyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL002023
SMILES CCOC(=O)c1c(NCc2cc(Cl)ccc2O)sc2c1CCCC2
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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 C18H20ClNO3S MW 365.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO3S/c1-2-23-18(22)16-13-5-3-4-6-15(13)24-17(16)20-10-11-9-12(19)7-8-14(11)21/h7-9,20-21H,2-6,10H2,1H3InChIKey
GTKGNSBIAYJFIP-UHFFFAOYSA-NSynonyms
342379-67-3342379673
CCOC(=O)C1=C(SC2=C1CCCC2)NCC3=C(C=CC(=C3)Cl)O
ethyl2((5chloro2hydroxybenzyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((5chloro2hydroxybenzyl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
ethyl2((5chloro2hydroxyphenyl)methylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC18H20ClNO3Sc122318(22)1613534615(13)2417(16)201011912(19)7814(11)21h792021H2610H21H3
MFCD02324039
ZINC000000975730
ZINC00975730
ZINC975730
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