Vitas-M small molecule compound

methyl 2-{[(2-fluorophenyl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Catalog ID
STK408923
SMILES COC(=O)c1c(NC(=O)c2ccccc2F)sc2c1CCCCC2

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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 C18H18FNO3S MW 347.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18FNO3S/c1-23-18(22)15-12-8-3-2-4-10-14(12)24-17(15)20-16(21)11-7-5-6-9-13(11)19/h5-7,9H,2-4,8,10H2,1H3,(H,20,21)
InChIKey
QQWJREJKQYXAFQ-UHFFFAOYSA-N
Synonyms
297158-84-0
297158840
COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC=CC=C3F
InChI=1SC18H18FNO3Sc12318(22)151283241014(12)2417(15)2016(21)11756913(11)19h579H24810H21H3(H2021)
methyl2(((2fluorophenyl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((2fluorobenzoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01823775
ZINC000000227529
ZINC00227529
ZINC227529

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Available files

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