Vitas-M small molecule compound
4-methoxy-N-({4-methyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)benzamide
Catalog ID
STK289079
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1C)SCc1cccc(c1)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 C20H22N4O2S MW 382.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2S/c1-14-5-4-6-15(11-14)13-27-20-23-22-18(24(20)2)12-21-19(25)16-7-9-17(26-3)10-8-16/h4-11H,12-13H2,1-3H3,(H,21,25)InChIKey
CYAPEYDBBZXUGA-UHFFFAOYSA-NSynonyms
4METHOXYN((4METHYL5((3METHYLBENZYL)SULFANYL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
4METHOXYN((4METHYL5((3METHYLPHENYL)METHYLSULFANYL)124TRIAZOL3YL)METHYL)BENZAMIDE
CC1=CC(=CC=C1)CSC2=NN=C(N2C)CNC(=O)C3=CC=C(C=C3)OC
InChI=1SC20H22N4O2Sc11454615(1114)132720232218(24(20)2)122119(25)167917(263)10816h411H1213H213H3(H2125)
MFCD06635722
ZINC000004868866
ZINC04868866
ZINC4868866
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