Vitas-M small molecule compound
3-[(4-chlorobenzyl)sulfanyl]-4-(3,4-dimethylphenyl)-5-methyl-4H-1,2,4-triazole
Catalog ID
STL375397
SMILES Clc1ccc(cc1)CSc1nnc(n1c1ccc(c(c1)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 C18H18ClN3S MW 343.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3S/c1-12-4-9-17(10-13(12)2)22-14(3)20-21-18(22)23-11-15-5-7-16(19)8-6-15/h4-10H,11H2,1-3H3InChIKey
UXOMZHAJYHVOLV-UHFFFAOYSA-NSynonyms
3((4chlorobenzyl)sulfanyl)4(34dimethylphenyl)5methyl4H124triazole
3((4CHLOROPHENYL)METHYLSULFANYL)4(34DIMETHYLPHENYL)5METHYL124TRIAZOLE
CC1=C(C=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Cl)C)C
InChI=1SC18H18ClN3Sc1124917(1013(12)2)2214(3)202118(22)2311155716(19)8615h410H11H213H3
MFCD03861986
ZINC000000479235
ZINC00479235
ZINC479235
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