Vitas-M small molecule compound

3-chloro-6-methoxy-N-[(tetrahydrofuran-2-ylmethyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Catalog ID
STK119665
SMILES COc1ccc2c(c1)sc(c2Cl)C(=O)NC(=S)NCC1CCCO1

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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 C16H17ClN2O3S2 MW 384.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN2O3S2/c1-21-9-4-5-11-12(7-9)24-14(13(11)17)15(20)19-16(23)18-8-10-3-2-6-22-10/h4-5,7,10H,2-3,6,8H2,1H3,(H2,18,19,20,23)
InChIKey
HFQUPJVHNZYGKE-UHFFFAOYSA-N
Synonyms
590400-23-0
3CHLORO6METHOXYN((((TETRAHYDRO2FURANYL)METHYL)AMINO)THIOXOMETHYL)BENZO(B)THIOPHENE2CARBOXAMIDE
3CHLORO6METHOXYN((TETRAHYDROFURAN2YLMETHYL)CARBAMOTHIOYL)1BENZOTHIOPHENE2CARBOXAMIDE
3CHLORO6METHOXYN(OXOLAN2YLMETHYLCARBAMOTHIOYL)1BENZOTHIOPHENE2CARBOXAMIDE
590400230
BENZO(B)THIOPHENE2CARBOXAMIDE3CHLORO6METHOXYN((((TETRAHYDROFURAN2YL)METHYL)AMINO)THIOXOMETHYL)
COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NCC3CCCO3)Cl
InChI=1SC16H17ClN2O3S2c1219451112(79)2414(13(11)17)15(20)1916(23)188103262210h45710H2368H21H3(H218192023)
MFCD03590210
ZINC000012042123
ZINC000012042127

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Available files

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