Vitas-M small molecule compound

2-{[(4-methoxyphenyl)carbonyl]amino}-N-(prop-2-en-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK811462
SMILES C=CCNC(=O)c1c(NC(=O)c2ccc(cc2)OC)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 C20H22N2O3S MW 370.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3S/c1-3-12-21-19(24)17-15-6-4-5-7-16(15)26-20(17)22-18(23)13-8-10-14(25-2)11-9-13/h3,8-11H,1,4-7,12H2,2H3,(H,21,24)(H,22,23)
InChIKey
MEUWIRROUUKAJA-UHFFFAOYSA-N
Synonyms
459180-48-4
2(((4methoxyphenyl)carbonyl)amino)N(prop2en1yl)4567tetrahydro1benzothiophene3carboxamide
2((4methoxybenzoyl)amino)Nprop2enyl4567tetrahydro1benzothiophene3carboxamide
459180484
COC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCC=C
InChI=1SC20H22N2O3Sc13122119(24)1715645716(15)2620(17)2218(23)1381014(252)11913h3811H14712H22H3(H2124)(H2223)
MFCD02978254
ZINC000002668111
ZINC02668111
ZINC2668111

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.