Vitas-M small molecule compound
3-{5-[(4-chlorobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl}aniline
Catalog ID
STK130638
SMILES Clc1ccc(cc1)CSc1nnc(n1c1ccccc1)c1cccc(c1)N
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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 C21H17ClN4S MW 392.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4S/c22-17-11-9-15(10-12-17)14-27-21-25-24-20(16-5-4-6-18(23)13-16)26(21)19-7-2-1-3-8-19/h1-13H,14,23H2InChIKey
VZRMYUMAQZVFPU-UHFFFAOYSA-NSynonyms
3(5((4CHLOROBENZYL)SULFANYL)4PHENYL4H124TRIAZOL3YL)ANILINE
3(5((4CHLOROPHENYL)METHYLSULFANYL)4PHENYL124TRIAZOL3YL)ANILINE
C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Cl)C4=CC(=CC=C4)N
InChI=1SC21H17ClN4Sc221711915(101217)142721252420(1654618(23)1316)26(21)197213819h113H1423H2
MFCD04330693
ZINC000001113521
ZINC01113521
ZINC1113521
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