Vitas-M small molecule compound

methyl 2-{[(4-tert-butylphenyl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK862116
SMILES COC(=O)c1c(NC(=O)c2ccc(cc2)C(C)(C)C)sc2c1CCC2

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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 C20H23NO3S MW 357.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO3S/c1-20(2,3)13-10-8-12(9-11-13)17(22)21-18-16(19(23)24-4)14-6-5-7-15(14)25-18/h8-11H,5-7H2,1-4H3,(H,21,22)
InChIKey
WZMFQGOOHMUOTQ-UHFFFAOYSA-N
Synonyms
324577-47-1
324577471
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC
InChI=1SC20H23NO3Sc120(23)1310812(91113)17(22)211816(19(23)244)1465715(14)2518h811H57H214H3(H2122)
methyl2(((4tertbutylphenyl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((4TERTBUTYLBENZOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2(4(TERTBUTYL)BENZAMIDO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD01072689
ZINC000000655391
ZINC00655391
ZINC655391

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Available files

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