Vitas-M small molecule compound
2-({4-amino-5-[3-(propan-2-yloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,5-dimethylphenyl)acetamide
Catalog ID
STL340888
SMILES O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1N)c1cccc(c1)OC(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 C21H25N5O2S MW 411.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2S/c1-13(2)28-18-7-5-6-16(11-18)20-24-25-21(26(20)22)29-12-19(27)23-17-9-14(3)8-15(4)10-17/h5-11,13H,12,22H2,1-4H3,(H,23,27)InChIKey
CGFWHEDUCOVAMU-UHFFFAOYSA-NSynonyms
573972-81-32((4amino5(3(propan2yloxy)phenyl)4H124triazol3yl)sulfanyl)N(35dimethylphenyl)acetamide
2((4amino5(3isopropoxyphenyl)4H124triazol3yl)thio)N(35dimethylphenyl)acetamide
2((4AMINO5(3PROPAN2YLOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(35DIMETHYLPHENYL)ACETAMIDE
2(4AMINO5(3(METHYLETHOXY)PHENYL)(124TRIAZOL3YLTHIO))N(35DIMETHYLPHENYL)ACETAMIDE
573972813
CC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)OC(C)C)C
InChI=1SC21H25N5O2Sc113(2)281875616(1118)20242521(26(20)22)291219(27)2317914(3)815(4)1017h51113H1222H214H3(H2327)
MFCD04023162
ZINC000002367628
ZINC02367628
ZINC2367628
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