Vitas-M small molecule compound

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

Catalog ID
STK075007
SMILES CCOC(=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 C21H25NO3S MW 371.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO3S/c1-5-25-20(24)17-15-7-6-8-16(15)26-19(17)22-18(23)13-9-11-14(12-10-13)21(2,3)4/h9-12H,5-8H2,1-4H3,(H,22,23)
InChIKey
UEBMMNXDVVLIMR-UHFFFAOYSA-N
Synonyms
301224-23-7
301224237
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC=C(C=C3)C(C)(C)C
CCOC(=O)c1c(NC(=O)c2ccc(cc2)C(C)(C)C)sc2c1CCC2
ETHYL2(((4TERTBUTYLPHENYL)CARBONYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ETHYL2((4TERTBUTYLBENZOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ETHYL2(4(TERTBUTYL)BENZAMIDO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
InChI=1SC21H25NO3Sc152520(24)171576816(15)2619(17)2218(23)1391114(121013)21(23)4h912H58H214H3(H2223)
MFCD00729579
STK075007
ZINC000000829051
ZINC00829051
ZINC829051

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Available files

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