Vitas-M small molecule compound

N-benzyl-N'-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)propanediamide

Catalog ID
STK610744
SMILES N#Cc1c(NC(=O)CC(=O)NCc2ccccc2)sc2c1CC(C)(C)OC2

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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 C20H21N3O3S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S/c1-20(2)9-14-15(10-21)19(27-16(14)12-26-20)23-18(25)8-17(24)22-11-13-6-4-3-5-7-13/h3-7H,8-9,11-12H2,1-2H3,(H,22,24)(H,23,25)
InChIKey
QCOXBBCLHPCSOQ-UHFFFAOYSA-N
Synonyms
898638-01-2
898638012
CC1(CC2=C(CO1)SC(=C2C#N)NC(=O)CC(=O)NCC3=CC=CC=C3)C
InChI=1SC20H21N3O3Sc120(2)91415(1021)19(2716(14)122620)2318(25)817(24)2211136435713h37H891112H212H3(H2224)(H2325)
MFCD08290267
N1benzylN3(3cyano55dimethyl57dihydro4Hthieno(23c)pyran2yl)malonamide
NbenzylN(3cyano55dimethyl47dihydro5Hthieno(23c)pyran2yl)propanediamide
NbenzylN(3cyano55dimethyl47dihydrothieno(23c)pyran2yl)propanediamide
ZINC000006759211
ZINC06759211
ZINC6759211

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Available files

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