Vitas-M small molecule compound

4-[({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzonitrile

Catalog ID
STL041936
SMILES N#Cc1ccc(cc1)CSc1nnc(n1CC)COc1ccc(cc1)Cl

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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 C19H17ClN4OS MW 384.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN4OS/c1-2-24-18(12-25-17-9-7-16(20)8-10-17)22-23-19(24)26-13-15-5-3-14(11-21)4-6-15/h3-10H,2,12-13H2,1H3
InChIKey
LENOLMBNLMQEEO-UHFFFAOYSA-N
Synonyms
848999-99-5
4(((5((4CHLOROPHENOXY)METHYL)4ETHYL124TRIAZOL3YL)THIO)METHYL)BENZONITRILE
4(((5((4chlorophenoxy)methyl)4ethyl4H124triazol3yl)sulfanyl)methyl)benzonitrile
4(((5((4chlorophenoxy)methyl)4ethyl4H124triazol3yl)thio)methyl)benzonitrile
4(((5(4CHLOROPHENOXYMETHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)METHYL)BENZONITRILE
4((5((4CHLORANYLPHENOXY)METHYL)4ETHYL124TRIAZOL3YL)SULFANYLMETHYL)BENZENECARBONITRILE
4((5((4CHLOROPHENOXY)METHYL)4ETHYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
4((5((4CHLOROPHENOXY)METHYL)4ETHYL124TRIAZOL3YLTHIO)METHYL)BENZENECARBONITRILE
848999995
CCN1C(=NN=C1SCC2=CC=C(C=C2)C#N)COC3=CC=C(C=C3)Cl
InChI=1SC19H17ClN4OSc122418(1225179716(20)81017)222319(24)2613155314(1121)4615h310H21213H21H3
MFCD05679768
ZINC000002448588
ZINC02448588
ZINC2448588

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Available files

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