Vitas-M small molecule compound
4-{[6-tert-butyl-3-(propan-2-ylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK471367
SMILES CC(NC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CCC(C2)C(C)(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 C20H30N2O4S MW 394.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H30N2O4S/c1-11(2)21-18(26)17-13-7-6-12(20(3,4)5)10-14(13)27-19(17)22-15(23)8-9-16(24)25/h11-12H,6-10H2,1-5H3,(H,21,26)(H,22,23)(H,24,25)InChIKey
SJHNAKHYQHPONL-UHFFFAOYSA-NSynonyms
4((6tertbutyl3(propan2ylcarbamoyl)4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
CC(C)NC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC(=O)CCC(=O)O
InChI=1SC20H30N2O4Sc111(2)2118(26)17137612(20(34)5)1014(13)2719(17)2215(23)8916(24)25h1112H610H215H3(H2126)(H2223)(H2425)
MFCD06025460
ZINC000017080677
ZINC000017080678
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