Vitas-M small molecule compound
3-[(2-hydroxy-4,5-dihydro-3H-1-benzazepin-3-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)propanamide
Catalog ID
STK638907
SMILES COc1cc(NC(=O)CCSC2CCc3c(N=C2O)cccc3)cc(c1OC)OC
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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 C22H26N2O5S MW 430.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O5S/c1-27-17-12-15(13-18(28-2)21(17)29-3)23-20(25)10-11-30-19-9-8-14-6-4-5-7-16(14)24-22(19)26/h4-7,12-13,19H,8-11H2,1-3H3,(H,23,25)(H,24,26)InChIKey
YHGWNKOREXABGQ-UHFFFAOYSA-NSynonyms
1010894-81-11010894811
3((2hydroxy45dihydro3H1benzazepin3yl)sulfanyl)N(345trimethoxyphenyl)propanamide
3((2oxo1345tetrahydro1benzazepin3yl)sulfanyl)N(345trimethoxyphenyl)propanamide
COC1=CC(=CC(=C1OC)OC)NC(=O)CCSC2CCC3=CC=CC=C3NC2=O
InChI=1SC22H26N2O5Sc127171215(1318(282)21(17)293)2320(25)101130199814645716(14)2422(19)26h47121319H811H213H3(H2325)(H2426)
MFCD18161823
ZINC000012407989
ZINC000012407991
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