Vitas-M small molecule compound
1-[1,4-bis(4-chlorophenyl)-5-(thiophen-2-yl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone
Catalog ID
STK723647
SMILES Clc1ccc(cc1)N1N=C(N(C1c1cccs1)c1ccc(cc1)Cl)C(=O)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 C20H15Cl2N3OS MW 416.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15Cl2N3OS/c1-13(26)19-23-25(17-10-6-15(22)7-11-17)20(18-3-2-12-27-18)24(19)16-8-4-14(21)5-9-16/h2-12,20H,1H3InChIKey
XXLLDOLPZPSGMX-UHFFFAOYSA-NSynonyms
1(14BIS(4CHLOROPHENYL)5(2THIENYL)45DIHYDRO1H124TRIAZOL3YL)ETHANONE
1(14bis(4chlorophenyl)5(thiophen2yl)45dihydro1H124triazol3yl)ethanone
1(24BIS(4CHLOROPHENYL)3THIOPHEN2YL3H124TRIAZOL5YL)ETHANONE
CC(=O)C1=NN(C(N1C2=CC=C(C=C2)Cl)C3=CC=CS3)C4=CC=C(C=C4)Cl
InChI=1SC20H15Cl2N3OSc113(26)192325(1710615(22)71117)20(1832122718)24(19)168414(21)5916h21220H1H3
MFCD01306408
ZINC000002189049
ZINC000002189050
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