Vitas-M small molecule compound

N-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

Catalog ID
STK463442
SMILES Cc1onc(c1C(=O)Nc1sc2c(c1C(=O)N)CCC2)c1c(F)cccc1Cl

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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 C19H15ClFN3O3S MW 419.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClFN3O3S/c1-8-13(16(24-27-8)15-10(20)5-3-6-11(15)21)18(26)23-19-14(17(22)25)9-4-2-7-12(9)28-19/h3,5-6H,2,4,7H2,1H3,(H2,22,25)(H,23,26)
InChIKey
XCROIRTZLZMRII-UHFFFAOYSA-N
Synonyms

2((3(2CHLORO6FLUOROPHENYL)5METHYLISOXAZOL4YL)CARBONYLAMINO)456TRIHYDROCYCLOPENTA(12B)THIOPHENE3CARBOXAMIDE
CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3=C(C4=C(S3)CCC4)C(=O)N
InChI=1SC19H15ClFN3O3Sc1813(16(24278)1510(20)53611(15)21)18(26)231914(17(22)25)942712(9)2819h356H247H21H3(H22225)(H2326)
MFCD06004139
N(3(AMINOCARBONYL)56DIHYDRO4HCYCLOPENTA(B)THIEN2YL)3(2CHLORO6FLUOROPHENYL)5METHYL4ISOXAZOLECARBOXAMIDE
N(3carbamoyl56dihydro4Hcyclopenta(b)thiophen2yl)3(2chloro6fluorophenyl)5methyl12oxazole4carboxamide
ZINC000001053492
ZINC01053492
ZINC1053492

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Available files

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