Vitas-M small molecule compound
2-({4-[(4-methylpiperidin-1-yl)carbonothioyl]phenoxy}methyl)benzonitrile
Catalog ID
STL376421
SMILES N#Cc1ccccc1COc1ccc(cc1)C(=S)N1CCC(CC1)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 C21H22N2OS MW 350.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2OS/c1-16-10-12-23(13-11-16)21(25)17-6-8-20(9-7-17)24-15-19-5-3-2-4-18(19)14-22/h2-9,16H,10-13,15H2,1H3InChIKey
NLQMCDKLZMOSJI-UHFFFAOYSA-NSynonyms
2((4((4methylpiperidin1yl)carbonothioyl)phenoxy)methyl)benzonitrile
2((4((4METHYLPIPERIDIN1YL)CARBOTHIOYL)PHENOXY)METHYL)BENZONITRILE
2((4(4METHYLPIPERIDINE1CARBOTHIOYL)PHENOXY)METHYL)BENZONITRILE
CC1CCN(CC1)C(=S)C2=CC=C(C=C2)OCC3=CC=CC=C3C#N
InChI=1SC21H22N2OSc116101223(131116)21(25)176820(9717)241519532418(19)1422h2916H101315H21H3
MFCD05998290
ZINC000001072954
ZINC01072954
ZINC1072954
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