Vitas-M small molecule compound

N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4-dichloro-1-benzothiophene-2-carboxamide

Catalog ID
STK423019
SMILES CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1sc2c(c1Cl)c(Cl)ccc2

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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 C19H16Cl2N2O2S2 MW 439.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16Cl2N2O2S2/c1-8-5-6-9-12(7-8)27-19(13(9)17(22)24)23-18(25)16-15(21)14-10(20)3-2-4-11(14)26-16/h2-4,8H,5-7H2,1H3,(H2,22,24)(H,23,25)
InChIKey
DRKLODRBHHVWPZ-UHFFFAOYSA-N
Synonyms

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(C4=C(S3)C=CC=C4Cl)Cl
InChI=1SC19H16Cl2N2O2S2c1856912(78)2719(13(9)17(22)24)2318(25)1615(21)1410(20)32411(14)2616h248H57H21H3(H22224)(H2325)
MFCD02244670
N(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)34dichloro1benzothiophene2carboxamide
ZINC000000648987
ZINC000000648989

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Available files

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