Vitas-M small molecule compound
5-{[3-(benzylcarbamoyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-3-methyl-5-oxopentanoic acid
Catalog ID
STK470740
SMILES CC(CC(=O)O)CC(=O)Nc1sc2c(c1C(=O)NCc1ccccc1)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 C23H28N2O4S MW 428.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O4S/c1-14-8-9-17-18(10-14)30-23(25-19(26)11-15(2)12-20(27)28)21(17)22(29)24-13-16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3,(H,24,29)(H,25,26)(H,27,28)InChIKey
VSGQYJJJBFYKBC-UHFFFAOYSA-NSynonyms
5((3(benzylcarbamoyl)6methyl4567tetrahydro1benzothiophen2yl)amino)3methyl5oxopentanoicacid
CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=CC=C3)NC(=O)CC(C)CC(=O)O
InChI=1SC23H28N2O4Sc114891718(1014)3023(2519(26)1115(2)1220(27)28)21(17)22(29)2413166435716h371415H813H212H3(H2429)(H2526)(H2728)
MFCD06021667
ZINC000017096057
ZINC000017096060
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Check stock on Vitas-MAvailable files
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