Vitas-M small molecule compound
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-nitrophenoxy)acetamide
Catalog ID
STK947317
SMILES N#Cc1c(NC(=O)COc2ccccc2[N+](=O)[O-])sc2c1CCC(C2)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 C21H23N3O4S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S/c1-21(2,3)13-8-9-14-15(11-22)20(29-18(14)10-13)23-19(25)12-28-17-7-5-4-6-16(17)24(26)27/h4-7,13H,8-10,12H2,1-3H3,(H,23,25)InChIKey
VXXXZVFGFISABN-UHFFFAOYSA-NSynonyms
362680-93-1362680931
CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)COC3=CC=CC=C3(N+)(=O)(O)
InChI=1SC21H23N3O4Sc121(23)13891415(1122)20(2918(14)1013)2319(25)122817754616(17)24(26)27h4713H81012H213H3(H2325)
MFCD01919754
N#Cc1c(NC(=O)COc2ccccc2(N+)(=O)(O))sc2c1CCC(C2)C(C)(C)C
N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)2(2nitrophenoxy)acetamide
ZINC000000695579
ZINC000000695580
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