Vitas-M small molecule compound
3-[(4-tert-butylbenzyl)sulfanyl]-5-(4-tert-butylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Catalog ID
STL347861
SMILES C=CCn1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1ccc(cc1)C(C)(C)C
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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 C26H33N3S MW 419.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3S/c1-8-17-29-23(20-11-15-22(16-12-20)26(5,6)7)27-28-24(29)30-18-19-9-13-21(14-10-19)25(2,3)4/h8-16H,1,17-18H2,2-7H3InChIKey
DZDRZIXWNRDWLI-UHFFFAOYSA-NSynonyms
861627-94-33((4tertbutylbenzyl)sulfanyl)5(4tertbutylphenyl)4(prop2en1yl)4H124triazole
3(4TERTBUTYLPHENYL)5((4TERTBUTYLPHENYL)METHYLSULFANYL)4PROP2ENYL124TRIAZOLE
4allyl3((4(tertbutyl)benzyl)thio)5(4(tertbutyl)phenyl)4H124triazole
861627943
CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC26H33N3Sc18172923(20111522(161220)26(56)7)272824(29)30181991321(141019)25(23)4h816H11718H227H3
MFCD05684608
ZINC000005478386
ZINC05478386
ZINC5478386
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