Vitas-M small molecule compound
propan-2-yl ({5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Catalog ID
STK850970
SMILES CC(OC(=O)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)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 C21H23N3O3S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S/c1-15(2)27-20(25)14-28-21-23-22-19(24(21)17-7-5-4-6-8-17)13-26-18-11-9-16(3)10-12-18/h4-12,15H,13-14H2,1-3H3InChIKey
ZJJSWSFPBKDHGO-UHFFFAOYSA-NSynonyms
332948-73-9332948739
CC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)OC(C)C
InChI=1SC21H23N3O3Sc115(2)2720(25)142821232219(24(21)177546817)13261811916(3)101218h41215H1314H213H3
isopropyl2((4phenyl5((ptolyloxy)methyl)4H124triazol3yl)thio)acetate
METHYLETHYL2(5((4METHYLPHENOXY)METHYL)4PHENYL124TRIAZOL3YLTHIO)ACETATE
MFCD02739627
propan2yl((5((4methylphenoxy)methyl)4phenyl4H124triazol3yl)sulfanyl)acetate
propan2yl2((5((4methylphenoxy)methyl)4phenyl124triazol3yl)sulfanyl)acetate
ZINC000000888370
ZINC00888370
ZINC888370
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