Vitas-M small molecule compound

2-{[(2E)-3-(furan-2-yl)prop-2-enoyl]amino}-N-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK701459
SMILES CNC(=O)c1c(NC(=O)/C=C/c2ccco2)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 C17H18N2O3S MW 330.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O3S/c1-18-16(21)15-12-6-2-3-7-13(12)23-17(15)19-14(20)9-8-11-5-4-10-22-11/h4-5,8-10H,2-3,6-7H2,1H3,(H,18,21)(H,19,20)/b9-8+
InChIKey
MJEPGVPNZLXOJH-CMDGGOBGSA-N
Synonyms

2(((2E)3(furan2yl)prop2enoyl)amino)Nmethyl4567tetrahydro1benzothiophene3carboxamide
2(((E)3(furan2yl)prop2enoyl)amino)Nmethyl4567tetrahydro1benzothiophene3carboxamide
CNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C=CC3=CC=CO3
CNC(=O)c1c(NC(=O)C=Cc2ccco2)sc2c1CCCC2
InChI=1SC17H18N2O3Sc11816(21)1512623713(12)2317(15)1914(20)981154102211h45810H2367H21H3(H1821)(H1920)b98+
MFCD01458864
ZINC000001452657
ZINC01452657
ZINC1452657

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Available files

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