Vitas-M small molecule compound
5-{[(3-chloro-2-methylphenyl)amino]methyl}-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK769971
SMILES Cc1c(NCc2n[nH]c(=S)n2CC=C)cccc1Cl
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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 C13H15ClN4S MW 294.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15ClN4S/c1-3-7-18-12(16-17-13(18)19)8-15-11-6-4-5-10(14)9(11)2/h3-6,15H,1,7-8H2,2H3,(H,17,19)InChIKey
GCLDEFJGCAMIGA-UHFFFAOYSA-NSynonyms
3((3CHLORO2METHYLANILINO)METHYL)4PROP2ENYL1H124TRIAZOLE5THIONE
5(((3chloro2methylphenyl)amino)methyl)4(prop2en1yl)24dihydro3H124triazole3thione
CC1=C(C=CC=C1Cl)NCC2=NNC(=S)N2CC=C
Cc1c(NCc2n(nH)c(=S)n2CC=C)cccc1Cl
InChI=1SC13H15ClN4Sc1371812(161713(18)19)8151164510(14)9(11)2h3615H178H22H3(H1719)
MFCD03763908
ZINC000002469703
ZINC02469703
ZINC2469703
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