Vitas-M small molecule compound
3-[(4-tert-butylphenoxy)methyl]-5-{[(2-methylnaphthalen-1-yl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Catalog ID
STK735697
SMILES Cc1ccc2c(c1CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C(C)(C)C)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 C31H31N3OS MW 493.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3OS/c1-22-14-15-23-10-8-9-13-27(23)28(22)21-36-30-33-32-29(34(30)25-11-6-5-7-12-25)20-35-26-18-16-24(17-19-26)31(2,3)4/h5-19H,20-21H2,1-4H3InChIKey
QRIQCUYKXLOFEG-UHFFFAOYSA-NSynonyms
3((4tertbutylphenoxy)methyl)5(((2methylnaphthalen1yl)methyl)sulfanyl)4phenyl4H124triazole
3((4TERTBUTYLPHENOXY)METHYL)5((2METHYLNAPHTHALEN1YL)METHYLSULFANYL)4PHENYL124TRIAZOLE
CC1=C(C2=CC=CC=C2C=C1)CSC3=NN=C(N3C4=CC=CC=C4)COC5=CC=C(C=C5)C(C)(C)C
InChI=1SC31H31N3OSc12214152310891327(23)28(22)213630333229(34(30)25116571225)203526181624(171926)31(23)4h519H2021H214H3
MFCD01460034
ZINC000003666858
ZINC03666858
ZINC3666858
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