Vitas-M small molecule compound
4-({[4-ethyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STK279414
SMILES N#Cc1ccc(cc1)CSc1nnc(n1CC)c1ccc2c(c1)CCCC2
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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 C22H22N4S MW 374.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4S/c1-2-26-21(20-12-11-18-5-3-4-6-19(18)13-20)24-25-22(26)27-15-17-9-7-16(14-23)8-10-17/h7-13H,2-6,15H2,1H3InChIKey
IAAZWFQREWXGHV-UHFFFAOYSA-NSynonyms
4(((4ethyl5(5678tetrahydronaphthalen2yl)4H124triazol3yl)sulfanyl)methyl)benzonitrile
4((4ethyl5(5678tetrahydronaphthalen2yl)124triazol3yl)sulfanylmethyl)benzonitrile
CCN1C(=NN=C1SCC2=CC=C(C=C2)C#N)C3=CC4=C(CCCC4)C=C3
InChI=1SC22H22N4Sc122621(20121118534619(18)1320)242522(26)2715179716(1423)81017h713H2615H21H3
MFCD09269852
ZINC000009193353
ZINC09193353
ZINC9193353
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