Vitas-M small molecule compound

4-methoxy-N-({4-methyl-5-[(2-phenoxyethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)benzamide

Catalog ID
STK218757
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1C)SCCOc1ccccc1

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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 C20H22N4O3S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S/c1-24-18(14-21-19(25)15-8-10-16(26-2)11-9-15)22-23-20(24)28-13-12-27-17-6-4-3-5-7-17/h3-11H,12-14H2,1-2H3,(H,21,25)
InChIKey
SICRLDYVNFTPRB-UHFFFAOYSA-N
Synonyms

4METHOXYN((4METHYL5((2PHENOXYETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
4METHOXYN((4METHYL5((2PHENOXYETHYL)THIO)4H124TRIAZOL3YL)METHYL)BENZAMIDE
4METHOXYN((4METHYL5(2PHENOXYETHYLSULFANYL)124TRIAZOL3YL)METHYL)BENZAMIDE
CN1C(=NN=C1SCCOC2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)OC
InChI=1SC20H22N4O3Sc12418(142119(25)1581016(262)11915)222320(24)28131227176435717h311H1214H212H3(H2125)
MFCD06000542
ZINC000002868500
ZINC02868500
ZINC2868500

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Available files

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