Vitas-M small molecule compound
2-{[4-amino-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Catalog ID
STL339046
SMILES COc1ccc(cc1)NC(=O)CSc1nnc(n1N)c1ccc(cc1)C(C)(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/c1-21(2,3)15-7-5-14(6-8-15)19-24-25-20(26(19)22)29-13-18(27)23-16-9-11-17(28-4)12-10-16/h5-12H,13,22H2,1-4H3,(H,23,27)InChIKey
HRCPPOIBHJTYBK-UHFFFAOYSA-NSynonyms
840496-66-42((4amino5(4(tertbutyl)phenyl)4H124triazol3yl)thio)N(4methoxyphenyl)acetamide
2((4AMINO5(4TERTBUTYLPHENYL)124TRIAZOL3YL)SULFANYL)N(4METHOXYPHENYL)ACETAMIDE
2((4amino5(4tertbutylphenyl)4H124triazol3yl)sulfanyl)N(4methoxyphenyl)acetamide
2(4AMINO5(4(TERTBUTYL)PHENYL)(124TRIAZOL3YLTHIO))N(4METHOXYPHENYL)ACETAMIDE
840496664
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)NC3=CC=C(C=C3)OC
InChI=1SC21H25N5O2Sc121(23)157514(6815)19242520(26(19)22)291318(27)231691117(284)121016h512H1322H214H3(H2327)
MFCD04008233
ZINC000002522387
ZINC02522387
ZINC2522387
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