Vitas-M small molecule compound

N-(3-methoxypropyl)-2-{[(3-methylphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK514559
SMILES COCCCNC(=O)c1c(sc2c1CCCC2)NC(=O)c1cccc(c1)C

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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 C21H26N2O3S MW 386.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O3S/c1-14-7-5-8-15(13-14)19(24)23-21-18(20(25)22-11-6-12-26-2)16-9-3-4-10-17(16)27-21/h5,7-8,13H,3-4,6,9-12H2,1-2H3,(H,22,25)(H,23,24)
InChIKey
PINQOOKGSOWVQC-UHFFFAOYSA-N
Synonyms
797809-51-9
797809519
CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCCCOC
InChI=1SC21H26N2O3Sc11475815(1314)19(24)232118(20(25)2211612262)169341017(16)2721h57813H346912H212H3(H2225)(H2324)
MFCD05239187
N(3methoxypropyl)2(((3methylphenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxamide
N(3methoxypropyl)2((3methylbenzoyl)amino)4567tetrahydro1benzothiophene3carboxamide
ZINC000005027491
ZINC05027491
ZINC5027491

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Available files

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