Vitas-M small molecule compound

4-ethyl-3-(4-methylphenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole

Catalog ID
STL347241
SMILES CCn1c(SC/C=C/c2ccccc2)nnc1c1ccc(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 C20H21N3S MW 335.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3S/c1-3-23-19(18-13-11-16(2)12-14-18)21-22-20(23)24-15-7-10-17-8-5-4-6-9-17/h4-14H,3,15H2,1-2H3/b10-7+
InChIKey
RTIQJQUUPGXSSH-JXMROGBWSA-N
Synonyms
849027-07-2
3(cinnamylthio)4ethyl5(ptolyl)4H124triazole
4ethyl3(4methylphenyl)5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazole
4ETHYL3(4METHYLPHENYL)5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOLE
849027072
CCN1C(=NN=C1SCC=CC2=CC=CC=C2)C3=CC=C(C=C3)C
CCn1c(SCC=Cc2ccccc2)nnc1c1ccc(cc1)C
InChI=1SC20H21N3Sc132319(18131116(2)121418)212220(23)2415710178546917h414H315H212H3b107+
MFCD05681480
ZINC000002453556
ZINC02453556
ZINC2453556

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Available files

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