Vitas-M small molecule compound

2-{[4-(morpholin-4-ylcarbonothioyl)phenoxy]methyl}benzonitrile

Catalog ID
STK180305
SMILES N#Cc1ccccc1COc1ccc(cc1)C(=S)N1CCOCC1

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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 C19H18N2O2S MW 338.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O2S/c20-13-16-3-1-2-4-17(16)14-23-18-7-5-15(6-8-18)19(24)21-9-11-22-12-10-21/h1-8H,9-12,14H2
InChIKey
IFVRQMHFVNSORI-UHFFFAOYSA-N
Synonyms

2((4(MORPHOLIN4YLCARBONOTHIOYL)PHENOXY)METHYL)BENZONITRILE
2((4(MORPHOLINE4CARBOTHIOYL)PHENOXY)METHYL)BENZONITRILE
C1COCCN1C(=S)C2=CC=C(C=C2)OCC3=CC=CC=C3C#N
InChI=1SC19H18N2O2Sc201316312417(16)1423187515(6818)19(24)2191122121021h18H91214H2
MFCD02272435
ZINC000004705239
ZINC04705239
ZINC4705239

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.