Vitas-M small molecule compound
4-[({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzonitrile
Catalog ID
STK580584
SMILES CCOc1ccc(cc1)n1c(nnc1COc1ccc(cc1)Cl)SCc1ccc(cc1)C#N
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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 C25H21ClN4O2S MW 476.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN4O2S/c1-2-31-22-13-9-21(10-14-22)30-24(16-32-23-11-7-20(26)8-12-23)28-29-25(30)33-17-19-5-3-18(15-27)4-6-19/h3-14H,2,16-17H2,1H3InChIKey
VIIDFKAASAUMLC-UHFFFAOYSA-NSynonyms
896066-72-14(((5((4chlorophenoxy)methyl)4(4ethoxyphenyl)4H124triazol3yl)sulfanyl)methyl)benzonitrile
4(((5((4chlorophenoxy)methyl)4(4ethoxyphenyl)4H124triazol3yl)thio)methyl)benzonitrile
4(((5(4CHLOROPHENOXYMETHYL)4(4ETHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)METHYL)BENZONITRILE
4((5((4CHLOROPHENOXY)METHYL)4(4ETHOXYPHENYL)124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
4((5((4CHLOROPHENOXY)METHYL)4(4ETHOXYPHENYL)124TRIAZOL3YLTHIO)METHYL)BENZENECARBONITRILE
896066721
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)C#N)COC4=CC=C(C=C4)Cl
InChI=1SC25H21ClN4O2Sc12312213921(101422)3024(16322311720(26)81223)282925(30)3317195318(1527)4619h314H21617H21H3
MFCD06591221
ZINC000002430122
ZINC02430122
ZINC2430122
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