Vitas-M small molecule compound
1-({3-[(3,4-dimethylphenoxy)methyl]-4-methyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}methyl)piperidine-4-carboxamide
Catalog ID
STK733018
SMILES NC(=O)C1CCN(CC1)Cn1nc(n(c1=S)C)COc1ccc(c(c1)C)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 C19H27N5O2S MW 389.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27N5O2S/c1-13-4-5-16(10-14(13)2)26-11-17-21-24(19(27)22(17)3)12-23-8-6-15(7-9-23)18(20)25/h4-5,10,15H,6-9,11-12H2,1-3H3,(H2,20,25)InChIKey
AJUIQWILDPXQKZ-UHFFFAOYSA-NSynonyms
311791-80-71((3((34DIMETHYLPHENOXY)METHYL)4METHYL5SULFANYLIDENE124TRIAZOL1YL)METHYL)PIPERIDINE4CARBOXAMIDE
1((3((34dimethylphenoxy)methyl)4methyl5thioxo45dihydro1H124triazol1yl)methyl)piperidine4carboxamide
311791807
CC1=C(C=C(C=C1)OCC2=NN(C(=S)N2C)CN3CCC(CC3)C(=O)N)C
InChI=1SC19H27N5O2Sc1134516(1014(13)2)2611172124(19(27)22(17)3)12238615(7923)18(20)25h451015H691112H213H3(H22025)
MFCD01207059
ZINC000000896558
ZINC896558
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