Vitas-M small molecule compound

1-(2,6-dimethylpiperidin-1-yl)-2-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STL358137
SMILES CC1CCCC(N1C(=O)CSc1nnc(n1c1ccccc1)c1ccncc1)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 C22H25N5OS MW 407.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5OS/c1-16-7-6-8-17(2)26(16)20(28)15-29-22-25-24-21(18-11-13-23-14-12-18)27(22)19-9-4-3-5-10-19/h3-5,9-14,16-17H,6-8,15H2,1-2H3
InChIKey
FXNXNEFMNDYPDQ-UHFFFAOYSA-N
Synonyms

1((2R6S)26DIMETHYLPIPERIDIN1YL)2((4PHENYL5(PYRIDIN4YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
1((2S6S)26DIMETHYLPIPERIDIN1YL)2((4PHENYL5(PYRIDIN4YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(26dimethylpiperidin1yl)2((4phenyl5(pyridin4yl)4H124triazol3yl)sulfanyl)ethanone
1(26DIMETHYLPIPERIDIN1YL)2((4PHENYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ETHANONE
CC1CCCC(N1C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4)C
InChI=1SC22H25N5OSc11676817(2)26(16)20(28)152922252421(18111323141218)27(22)1994351019h359141617H6815H212H3
MFCD03996962
ZINC000001118362
ZINC000015011332

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Available files

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