Vitas-M small molecule compound

methyl {3-[(furan-2-ylmethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}carbamate

Catalog ID
STK461814
SMILES COC(=O)Nc1sc2c(c1C(=O)NCc1ccco1)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 C16H18N2O4S MW 334.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O4S/c1-21-16(20)18-15-13(11-6-2-3-7-12(11)23-15)14(19)17-9-10-5-4-8-22-10/h4-5,8H,2-3,6-7,9H2,1H3,(H,17,19)(H,18,20)
InChIKey
BQKNJQFCUMBCLJ-UHFFFAOYSA-N
Synonyms

COC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)NCC3=CC=CO3
InChI=1SC16H18N2O4Sc12116(20)181513(11623712(11)2315)14(19)179105482210h458H23679H21H3(H1719)(H1820)
methyl(3((furan2ylmethyl)carbamoyl)4567tetrahydro1benzothiophen2yl)carbamate
methylN(3(furan2ylmethylcarbamoyl)4567tetrahydro1benzothiophen2yl)carbamate
MFCD06004105
ZINC000001053400
ZINC01053400
ZINC1053400

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Available files

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