Vitas-M small molecule compound

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

Catalog ID
STK435616
SMILES CCc1c(C)sc(c1C(=O)OC(C)C)NC(=O)c1cc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

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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 C27H24Cl2N2O3S MW 527.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24Cl2N2O3S/c1-5-17-15(4)35-26(24(17)27(33)34-14(2)3)31-25(32)19-13-23(16-10-11-20(28)21(29)12-16)30-22-9-7-6-8-18(19)22/h6-14H,5H2,1-4H3,(H,31,32)
InChIKey
OVANJUHNJSEYOZ-UHFFFAOYSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)Cl)Cl)C
InChI=1SC27H24Cl2N2O3Sc151715(4)3526(24(17)27(33)3414(2)3)3125(32)191323(16101120(28)21(29)1216)3022976818(19)22h614H5H214H3(H3132)
ISOPROPYL2(((2(34DICHLOROPHENYL)4QUINOLINYL)CARBONYL)AMINO)4ETHYL5METHYL3THIOPHENECARBOXYLATE
METHYLETHYL2((2(34DICHLOROPHENYL)(4QUINOLYL))CARBONYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
MFCD01336989
propan2yl2(((2(34dichlorophenyl)quinolin4yl)carbonyl)amino)4ethyl5methylthiophene3carboxylate
PROPAN2YL2((2(34DICHLOROPHENYL)QUINOLINE4CARBONYL)AMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
ZINC000002081546
ZINC02081546
ZINC2081546

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Available files

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