Vitas-M small molecule compound
2-{[4-amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-bromophenyl)acetamide
Catalog ID
STL342036
SMILES COc1cc(ccc1OC)c1nnc(n1N)SCC(=O)Nc1cccc(c1)Br
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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 C18H18BrN5O3S MW 464.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN5O3S/c1-26-14-7-6-11(8-15(14)27-2)17-22-23-18(24(17)20)28-10-16(25)21-13-5-3-4-12(19)9-13/h3-9H,10,20H2,1-2H3,(H,21,25)InChIKey
CCYUTROGIOTNIL-UHFFFAOYSA-NSynonyms
586991-23-32((4AMINO5(34DIMETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(3BROMOPHENYL)ACETAMIDE
2((4amino5(34dimethoxyphenyl)4H124triazol3yl)sulfanyl)N(3bromophenyl)acetamide
2((4amino5(34dimethoxyphenyl)4H124triazol3yl)thio)N(3bromophenyl)acetamide
2(4AMINO5(34DIMETHOXYPHENYL)(124TRIAZOL3YLTHIO))N(3BROMOPHENYL)ACETAMIDE
586991233
COC1=C(C=C(C=C1)C2=NN=C(N2N)SCC(=O)NC3=CC(=CC=C3)Br)OC
InChI=1SC18H18BrN5O3Sc126147611(815(14)272)17222318(24(17)20)281016(25)211353412(19)913h39H1020H212H3(H2125)
MFCD04032071
ZINC000002395128
ZINC02395128
ZINC2395128
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