Vitas-M small molecule compound
N-[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(5-chlorothiophen-2-yl)quinoline-4-carboxamide
Catalog ID
STK375331
SMILES CCC(C1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(nc2c1cccc2)c1ccc(s1)Cl)(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 C28H28ClN3O2S2 MW 538.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClN3O2S2/c1-4-28(2,3)15-9-10-17-22(13-15)36-27(24(17)25(30)33)32-26(34)18-14-20(21-11-12-23(29)35-21)31-19-8-6-5-7-16(18)19/h5-8,11-12,14-15H,4,9-10,13H2,1-3H3,(H2,30,33)(H,32,34)InChIKey
LAKAAQDNPDLMTP-UHFFFAOYSA-NSynonyms
353472-09-0353472090
CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)Cl
InChI=1SC28H28ClN3O2S2c1428(23)159101722(1315)3627(24(17)25(30)33)3226(34)181420(21111223(29)3521)3119865716(18)19h5811121415H491013H213H3(H23033)(H3234)
MFCD01336262
N(3carbamoyl6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)2(5chlorothiophen2yl)quinoline4carboxamide
ZINC000002081421
ZINC000002081422
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