Vitas-M small molecule compound
2-{[4-amino-5-(3-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethoxyphenyl)acetamide
Catalog ID
STK987504
SMILES COc1cc(ccc1OC)NC(=O)CSc1nnc(n1N)c1cccc(c1)F
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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 C18H18FN5O3S MW 403.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18FN5O3S/c1-26-14-7-6-13(9-15(14)27-2)21-16(25)10-28-18-23-22-17(24(18)20)11-4-3-5-12(19)8-11/h3-9H,10,20H2,1-2H3,(H,21,25)InChIKey
GNHXXSBVVTWTCB-UHFFFAOYSA-NSynonyms
2((4AMINO5(3FLUOROPHENYL)124TRIAZOL3YL)SULFANYL)N(34DIMETHOXYPHENYL)ACETAMIDE
2((4amino5(3fluorophenyl)4H124triazol3yl)sulfanyl)N(34dimethoxyphenyl)acetamide
COC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)F)OC
InChI=1SC18H18FN5O3Sc126147613(915(14)272)2116(25)102818232217(24(18)20)1143512(19)811h39H1020H212H3(H2125)
MFCD18184258
ZINC000005676331
ZINC05676331
ZINC5676331
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