Vitas-M small molecule compound

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

Catalog ID
STK418685
SMILES CCCOC(=O)c1c(NC(=O)c2ccc(cc2)C(C)(C)C)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 C24H31NO3S MW 413.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO3S/c1-5-15-28-23(27)20-18-9-7-6-8-10-19(18)29-22(20)25-21(26)16-11-13-17(14-12-16)24(2,3)4/h11-14H,5-10,15H2,1-4H3,(H,25,26)
InChIKey
VOIDCJKKADCMAO-UHFFFAOYSA-N
Synonyms
354994-99-3
354994993
CCCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC24H31NO3Sc15152823(27)201897681019(18)2922(20)2521(26)16111317(141216)24(23)4h1114H51015H214H3(H2526)
MFCD01345870
propyl2(((4tertbutylphenyl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
propyl2((4tertbutylbenzoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ZINC000002082220
ZINC02082220
ZINC2082220

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Available files

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