Vitas-M small molecule compound

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

Catalog ID
STK418523
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)c1cc(nc2c1cccc2)c1cccc(c1)Br)CC

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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 C30H30BrN3O4S MW 608.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30BrN3O4S/c1-6-34(7-2)29(36)26-18(5)25(30(37)38-17(3)4)28(39-26)33-27(35)22-16-24(19-11-10-12-20(31)15-19)32-23-14-9-8-13-21(22)23/h8-17H,6-7H2,1-5H3,(H,33,35)
InChIKey
LIMTVDYARPDQNH-UHFFFAOYSA-N
Synonyms
352705-60-3
352705603
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)Br)C(=O)OC(C)C)C
InChI=1SC30H30BrN3O4Sc1634(72)29(36)2618(5)25(30(37)3817(3)4)28(3926)3327(35)221624(1911101220(31)1519)322314981321(22)23h817H67H215H3(H3335)
ISOPROPYL2(((2(3BROMOPHENYL)4QUINOLINYL)CARBONYL)AMINO)5((DIETHYLAMINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
MFCD01920320
propan2yl2(((2(3bromophenyl)quinolin4yl)carbonyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
PROPAN2YL2((2(3BROMOPHENYL)QUINOLINE4CARBONYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ZINC000008432196
ZINC08432196
ZINC8432196

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Available files

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