Vitas-M small molecule compound

2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide

Catalog ID
STK315854
SMILES NC(=O)c1c(sc(c1C)C)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)C(C)(C)C

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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 C27H27N3O2S MW 457.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O2S/c1-15-16(2)33-26(23(15)24(28)31)30-25(32)20-14-22(29-21-9-7-6-8-19(20)21)17-10-12-18(13-11-17)27(3,4)5/h6-14H,1-5H3,(H2,28,31)(H,30,32)
InChIKey
BDAWHUVNDGHQPM-UHFFFAOYSA-N
Synonyms
351000-53-8
2(4tertbutylphenyl)N(3carbamoyl45dimethylthiophen2yl)quinoline4carboxamide
351000538
CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)(C)C)C
InChI=1SC27H27N3O2Sc11516(2)3326(23(15)24(28)31)3025(32)201422(2921976819(20)21)17101218(131117)27(34)5h614H15H3(H22831)(H3032)
MFCD01924063
N(3(AMINOCARBONYL)45DIMETHYLTHIEN2YL)2(4TERTBUTYLPHENYL)QUINOLINE4CARBOXAMIDE
ZINC000002755599
ZINC02755599
ZINC2755599

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Available files

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