Vitas-M small molecule compound
ethyl {[4-(3,4-dimethylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Catalog ID
STL375592
SMILES CCOC(=O)CSc1nnc(n1c1ccc(c(c1)C)C)c1ccccc1
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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 C20H21N3O2S MW 367.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S/c1-4-25-18(24)13-26-20-22-21-19(16-8-6-5-7-9-16)23(20)17-11-10-14(2)15(3)12-17/h5-12H,4,13H2,1-3H3InChIKey
GCSQAWJZDCFPPH-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NN=C(N1C2=CC(=C(C=C2)C)C)C3=CC=CC=C3
ethyl((4(34dimethylphenyl)5phenyl4H124triazol3yl)sulfanyl)acetate
ETHYL2((4(34DIMETHYLPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)ACETATE
InChI=1SC20H21N3O2Sc142518(24)132620222119(168657916)23(20)17111014(2)15(3)1217h512H413H213H3
MFCD03998616
ZINC000001148162
ZINC01148162
ZINC1148162
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