Vitas-M small molecule compound
4-{[3-(benzylcarbamoyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK470976
SMILES O=C(Nc1sc2c(c1C(=O)NCc1ccccc1)CCC(C2)C(C)(C)C)CCC(=O)O
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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/c1-24(2,3)16-9-10-17-18(13-16)31-23(26-19(27)11-12-20(28)29)21(17)22(30)25-14-15-7-5-4-6-8-15/h4-8,16H,9-14H2,1-3H3,(H,25,30)(H,26,27)(H,28,29)InChIKey
XEEIZBXMEFASBO-UHFFFAOYSA-NSynonyms
4((3(benzylcarbamoyl)6tertbutyl4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=CC=C3)NC(=O)CCC(=O)O
InChI=1SC24H30N2O4Sc124(23)169101718(1316)3123(2619(27)111220(28)29)21(17)22(30)2514157546815h4816H914H213H3(H2530)(H2627)(H2829)
MFCD06021732
ZINC000019636918
ZINC000019636922
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