Vitas-M small molecule compound
4-{4-ethyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}aniline
Catalog ID
STK122502
SMILES CCn1c(nnc1c1ccc(cc1)N)SCc1cccc(c1)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 C18H20N4S MW 324.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4S/c1-3-22-17(15-7-9-16(19)10-8-15)20-21-18(22)23-12-14-6-4-5-13(2)11-14/h4-11H,3,12,19H2,1-2H3InChIKey
PQRDLGMJAIAYLD-UHFFFAOYSA-NSynonyms
4(4ETHYL5((3METHYLBENZYL)SULFANYL)4H124TRIAZOL3YL)ANILINE
4(4ETHYL5((3METHYLPHENYL)METHYLSULFANYL)124TRIAZOL3YL)ANILINE
CCN1C(=NN=C1SCC2=CC=CC(=C2)C)C3=CC=C(C=C3)N
InChI=1SC18H20N4Sc132217(157916(19)10815)202118(22)23121464513(2)1114h411H31219H212H3
MFCD03876529
ZINC000004676327
ZINC04676327
ZINC4676327
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