Vitas-M small molecule compound
3-[(3-chlorobenzyl)sulfanyl]-4-propyl-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazole
Catalog ID
STK491603
SMILES CCCn1c(nnc1c1csc2c1CCCC2)SCc1cccc(c1)Cl
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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 C20H22ClN3S2 MW 404.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN3S2/c1-2-10-24-19(17-13-25-18-9-4-3-8-16(17)18)22-23-20(24)26-12-14-6-5-7-15(21)11-14/h5-7,11,13H,2-4,8-10,12H2,1H3InChIKey
TUMLUUJGALPPCS-UHFFFAOYSA-NSynonyms
3((3chlorobenzyl)sulfanyl)4propyl5(4567tetrahydro1benzothiophen3yl)4H124triazole
3((3chlorophenyl)methylsulfanyl)4propyl5(4567tetrahydro1benzothiophen3yl)124triazole
CCCN1C(=NN=C1SCC2=CC(=CC=C2)Cl)C3=CSC4=C3CCCC4
InChI=1SC20H22ClN3S2c12102419(17132518943816(17)18)222320(24)26121465715(21)1114h571113H2481012H21H3
MFCD06105875
ZINC000014053367
ZINC14053367
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