Vitas-M small molecule compound
N-[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide
Catalog ID
STK418407
SMILES CCC(C1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(nc2c1cccc2)c1ccc(s1)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 C29H31N3O2S2 MW 517.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O2S2/c1-5-29(3,4)17-11-12-19-24(14-17)36-28(25(19)26(30)33)32-27(34)20-15-22(23-13-10-16(2)35-23)31-21-9-7-6-8-18(20)21/h6-10,13,15,17H,5,11-12,14H2,1-4H3,(H2,30,33)(H,32,34)InChIKey
ZFXKXDPNUPFEAM-UHFFFAOYSA-NSynonyms
353784-96-0353784960
CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)C
InChI=1SC29H31N3O2S2c1529(34)1711121924(1417)3628(25(19)26(30)33)3227(34)201522(23131016(2)3523)3121976818(20)21h610131517H5111214H214H3(H23033)(H3234)
MFCD01835068
N(3carbamoyl6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)2(5methylthiophen2yl)quinoline4carboxamide
ZINC000002085482
ZINC000002085483
ZINC02085483
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