Vitas-M small molecule compound

3-(4-tert-butylphenyl)-5-[(4-methylbenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole

Catalog ID
STK570442
SMILES C=CCn1c(nnc1c1ccc(cc1)C(C)(C)C)SCc1ccc(cc1)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 C23H27N3S MW 377.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3S/c1-6-15-26-21(19-11-13-20(14-12-19)23(3,4)5)24-25-22(26)27-16-18-9-7-17(2)8-10-18/h6-14H,1,15-16H2,2-5H3
InChIKey
XZBFUJZJDSXGNF-UHFFFAOYSA-N
Synonyms
861628-97-9
3(4TERTBUTYLPHENYL)5(((4METHYLPHENYL)METHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOLE
3(4tertbutylphenyl)5((4methylbenzyl)sulfanyl)4(prop2en1yl)4H124triazole
3(4TERTBUTYLPHENYL)5((4METHYLPHENYL)METHYLSULFANYL)4PROP2ENYL124TRIAZOLE
4allyl3(4(tertbutyl)phenyl)5((4methylbenzyl)thio)4H124triazole
5(4(TERTBUTYL)PHENYL)3((4METHYLPHENYL)METHYLTHIO)4PROP2ENYL124TRIAZOLE
861628979
CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC23H27N3Sc16152621(19111320(141219)23(34)5)242522(26)2716189717(2)81018h614H11516H225H3
MFCD05684764
ZINC000005478438
ZINC05478438
ZINC5478438

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Available files

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