Vitas-M small molecule compound

3-methyl-5-({6-methyl-3-[(4-methylbenzyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}amino)-5-oxopentanoic acid

Catalog ID
STK470850
SMILES CC(CC(=O)O)CC(=O)Nc1sc2c(c1C(=O)NCc1ccc(cc1)C)CCC(C2)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 C24H30N2O4S MW 442.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2O4S/c1-14-4-7-17(8-5-14)13-25-23(30)22-18-9-6-15(2)10-19(18)31-24(22)26-20(27)11-16(3)12-21(28)29/h4-5,7-8,15-16H,6,9-13H2,1-3H3,(H,25,30)(H,26,27)(H,28,29)
InChIKey
TVOCJKRJVDSXRK-UHFFFAOYSA-N
Synonyms

3methyl5((6methyl3((4methylbenzyl)carbamoyl)4567tetrahydro1benzothiophen2yl)amino)5oxopentanoicacid
3methyl5((6methyl3((4methylphenyl)methylcarbamoyl)4567tetrahydro1benzothiophen2yl)amino)5oxopentanoicacid
CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=C(C=C3)C)NC(=O)CC(C)CC(=O)O
InChI=1SC24H30N2O4Sc1144717(8514)132523(30)22189615(2)1019(18)3124(22)2620(27)1116(3)1221(28)29h45781516H6913H213H3(H2530)(H2627)(H2829)
MFCD06021246
ZINC000019636781
ZINC000019636792

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Available files

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