Vitas-M small molecule compound
ethyl 2-{[N-(2-hydroxyethyl)-beta-alanyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK279975
SMILES OCCNCCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2
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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 C16H24N2O4S MW 340.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24N2O4S/c1-2-22-16(21)14-11-5-3-4-6-12(11)23-15(14)18-13(20)7-8-17-9-10-19/h17,19H,2-10H2,1H3,(H,18,20)InChIKey
DBXJMZBUCCYTSA-UHFFFAOYSA-NSynonyms
312607-40-2312607402
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCNCCO
ethyl2((N(2hydroxyethyl)betaalanyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(3((2hydroxyethyl)amino)propanamido)4567tetrahydrobenzo(b)thiophene3carboxylate
ethyl2(3(2hydroxyethylamino)propanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC16H24N2O4Sc122216(21)1411534612(11)2315(14)1813(20)781791019h1719H210H21H3(H1820)
MFCD00769534
ZINC000002258599
ZINC2258599
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