Vitas-M small molecule compound
1-benzyl-N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2,3-dimethyl-1H-indole-5-carboxamide
Catalog ID
STL174698
SMILES N#Cc1c(NC(=S)NC(=O)c2ccc3c(c2)c(C)c(n3Cc2ccccc2)C)sc2c1CCC(C2)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 C29H28N4OS2 MW 512.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4OS2/c1-17-9-11-22-24(15-30)28(36-26(22)13-17)32-29(35)31-27(34)21-10-12-25-23(14-21)18(2)19(3)33(25)16-20-7-5-4-6-8-20/h4-8,10,12,14,17H,9,11,13,16H2,1-3H3,(H2,31,32,34,35)InChIKey
PYUCXCNNHIUNFJ-UHFFFAOYSA-NSynonyms
438613-83-31benzylN((3cyano6methyl4567tetrahydro1benzothiophen2yl)carbamothioyl)23dimethyl1Hindole5carboxamide
1benzylN((3cyano6methyl4567tetrahydro1benzothiophen2yl)carbamothioyl)23dimethylindole5carboxamide
438613833
CC1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=CC4=C(C=C3)N(C(=C4C)C)CC5=CC=CC=C5
InChI=1SC29H28N4OS2c1179112224(1530)28(3626(22)1317)3229(35)3127(34)2110122523(1421)18(2)19(3)33(25)16207546820h4810121417H9111316H213H3(H231323435)
MFCD02605104
ZINC000002801892
ZINC000002801893
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