Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Catalog ID
STL346748
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)OCC)nnc1c1ccc(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 C25H30N4O2S MW 450.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O2S/c1-6-16-29-23(18-8-10-19(11-9-18)25(3,4)5)27-28-24(29)32-17-22(30)26-20-12-14-21(15-13-20)31-7-2/h6,8-15H,1,7,16-17H2,2-5H3,(H,26,30)InChIKey
RNVNPEXHPPAPKF-UHFFFAOYSA-NSynonyms
848992-30-32((4allyl5(4(tertbutyl)phenyl)4H124triazol3yl)thio)N(4ethoxyphenyl)acetamide
2((5(4tertbutylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(4ethoxyphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4ETHOXYPHENYL)ACETAMIDE
848992303
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC25H30N4O2Sc16162923(1881019(11918)25(34)5)272824(29)321722(30)2620121421(151320)3172h6815H171617H225H3(H2630)
MFCD05679080
ZINC000002446945
ZINC02446945
ZINC2446945
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