Vitas-M small molecule compound
5-({6-methyl-3-[(pyridin-3-ylmethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}amino)-5-oxopentanoic acid
Catalog ID
STK471392
SMILES CC1CCc2c(C1)sc(c2C(=O)NCc1cccnc1)NC(=O)CCCC(=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 C21H25N3O4S MW 415.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O4S/c1-13-7-8-15-16(10-13)29-21(24-17(25)5-2-6-18(26)27)19(15)20(28)23-12-14-4-3-9-22-11-14/h3-4,9,11,13H,2,5-8,10,12H2,1H3,(H,23,28)(H,24,25)(H,26,27)InChIKey
AQYQVJCXMYQZSY-UHFFFAOYSA-NSynonyms
5((6methyl3((pyridin3ylmethyl)carbamoyl)4567tetrahydro1benzothiophen2yl)amino)5oxopentanoicacid
5((6methyl3(pyridin3ylmethylcarbamoyl)4567tetrahydro1benzothiophen2yl)amino)5oxopentanoicacid
CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CN=CC=C3)NC(=O)CCCC(=O)O
InChI=1SC21H25N3O4Sc113781516(1013)2921(2417(25)52618(26)27)19(15)20(28)231214439221114h3491113H2581012H21H3(H2328)(H2425)(H2627)
MFCD06025169
ZINC000017090346
ZINC000017090347
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