Vitas-M small molecule compound

N,N-diethyl-2-{[4-(4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK059373
SMILES CCN(C(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccncc1)CC

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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 C20H23N5OS MW 381.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5OS/c1-4-24(5-2)18(26)14-27-20-23-22-19(16-10-12-21-13-11-16)25(20)17-8-6-15(3)7-9-17/h6-13H,4-5,14H2,1-3H3
InChIKey
PGBXYOVLRSXAMD-UHFFFAOYSA-N
Synonyms
499124-75-3
499124753
CCN(C(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccncc1)CC
CCN(CC)C(=O)CSC1=NN=C(N1C2=CC=C(C=C2)C)C3=CC=NC=C3
InChI=1SC20H23N5OSc1424(52)18(26)142720232219(16101221131116)25(20)178615(3)7917h613H4514H213H3
MFCD03224374
NNDIETHYL2((4(4METHYLPHENYL)5(PYRIDIN4YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
NNDIETHYL2((4(4METHYLPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
NNdiethyl2((5(pyridin4yl)4(ptolyl)4H124triazol3yl)thio)acetamide
NNDIETHYL2(4(4METHYLPHENYL)5(4PYRIDYL)(124TRIAZOL3YLTHIO))ACETAMIDE
STK059373
ZINC000000779228
ZINC00779228
ZINC779228

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Available files

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