Vitas-M small molecule compound

propan-2-yl 2-({[2-(3-bromophenyl)quinolin-4-yl]carbonyl}amino)-4-ethyl-5-methylthiophene-3-carboxylate

Catalog ID
STK435425
SMILES CCc1c(C)sc(c1C(=O)OC(C)C)NC(=O)c1cc(nc2c1cccc2)c1cccc(c1)Br

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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 C27H25BrN2O3S MW 537.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25BrN2O3S/c1-5-19-16(4)34-26(24(19)27(32)33-15(2)3)30-25(31)21-14-23(17-9-8-10-18(28)13-17)29-22-12-7-6-11-20(21)22/h6-15H,5H2,1-4H3,(H,30,31)
InChIKey
WZKMOIZVRXXZHS-UHFFFAOYSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)Br)C
InChI=1SC27H25BrN2O3Sc151916(4)3426(24(19)27(32)3315(2)3)3025(31)211423(17981018(28)1317)292212761120(21)22h615H5H214H3(H3031)
ISOPROPYL2(((2(3BROMOPHENYL)4QUINOLINYL)CARBONYL)AMINO)4ETHYL5METHYL3THIOPHENECARBOXYLATE
METHYLETHYL2((2(3BROMOPHENYL)(4QUINOLYL))CARBONYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
MFCD01338562
propan2yl2(((2(3bromophenyl)quinolin4yl)carbonyl)amino)4ethyl5methylthiophene3carboxylate
PROPAN2YL2((2(3BROMOPHENYL)QUINOLINE4CARBONYL)AMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
ZINC000002081508
ZINC02081508
ZINC2081508

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Available files

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