Vitas-M small molecule compound
6-[(3-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK471899
SMILES N#Cc1c(NC(=O)C2CC=CCC2C(=O)O)sc2c1CCC(C2)c1ccccc1
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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 C23H22N2O3S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O3S/c24-13-19-16-11-10-15(14-6-2-1-3-7-14)12-20(16)29-22(19)25-21(26)17-8-4-5-9-18(17)23(27)28/h1-7,15,17-18H,8-12H2,(H,25,26)(H,27,28)InChIKey
JWNVSQZZZYZRNF-UHFFFAOYSA-NSynonyms
6((3cyano6phenyl4567tetrahydro1benzothiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
C1CC2=C(CC1C3=CC=CC=C3)SC(=C2C#N)NC(=O)C4CC=CCC4C(=O)O
InChI=1SC23H22N2O3Sc24131916111015(146213714)1220(16)2922(19)2521(26)17845918(17)23(27)28h17151718H812H2(H2526)(H2728)
MFCD06026177
ZINC000017087396
ZINC000225773357
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