Vitas-M small molecule compound

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

Catalog ID
STK418144
SMILES COC(=O)c1c(NC(=O)C2CC2c2ccccc2)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 C21H23NO3S MW 369.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO3S/c1-25-21(24)18-14-10-6-3-7-11-17(14)26-20(18)22-19(23)16-12-15(16)13-8-4-2-5-9-13/h2,4-5,8-9,15-16H,3,6-7,10-12H2,1H3,(H,22,23)
InChIKey
KMJLDZFPMQDDHJ-UHFFFAOYSA-N
Synonyms
355000-12-3
355000123
COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3CC3C4=CC=CC=C4
InChI=1SC21H23NO3Sc12521(24)1814106371117(14)2620(18)2219(23)161215(16)138425913h245891516H3671012H21H3(H2223)
methyl2(((2phenylcyclopropyl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((2phenylcyclopropanecarbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01835310
ZINC000000670732
ZINC000000670736

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Available files

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