Vitas-M small molecule compound

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

Catalog ID
STK817096
SMILES COc1cccc(c1)C(=O)Nc1sc2c(c1C(=O)NCCc1ccccc1)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 C25H26N2O3S MW 434.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O3S/c1-30-19-11-7-10-18(16-19)23(28)27-25-22(20-12-5-6-13-21(20)31-25)24(29)26-15-14-17-8-3-2-4-9-17/h2-4,7-11,16H,5-6,12-15H2,1H3,(H,26,29)(H,27,28)
InChIKey
HDFNCXGBTBLYKU-UHFFFAOYSA-N
Synonyms

2(((3methoxyphenyl)carbonyl)amino)N(2phenylethyl)4567tetrahydro1benzothiophene3carboxamide
2((3methoxybenzoyl)amino)N(2phenylethyl)4567tetrahydro1benzothiophene3carboxamide
COC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCCC4=CC=CC=C4
InChI=1SC25H26N2O3Sc130191171018(1619)23(28)272522(2012561321(20)3125)24(29)261514178324917h2471116H561215H21H3(H2629)(H2728)
MFCD03861359
ZINC000000702506
ZINC00702506
ZINC702506

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Available files

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