Vitas-M small molecule compound
2-{[5-{[(4-chlorophenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Catalog ID
STL174574
SMILES CCOc1ccc(cc1)NC(=O)CSc1nnc(n1CC=C)CNc1ccc(cc1)Cl
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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 C22H24ClN5O2S MW 457.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O2S/c1-3-13-28-20(14-24-17-7-5-16(23)6-8-17)26-27-22(28)31-15-21(29)25-18-9-11-19(12-10-18)30-4-2/h3,5-12,24H,1,4,13-15H2,2H3,(H,25,29)InChIKey
DRFCIZVIAXAEBS-UHFFFAOYSA-NSynonyms
445288-09-52((4ALLYL5((4CHLOROANILINO)METHYL)4H124TRIAZOL3YL)SULFANYL)N(4ETHOXYPHENYL)ACETAMIDE
2((5(((4chlorophenyl)amino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(4ethoxyphenyl)acetamide
2((5((4CHLOROANILINO)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4ETHOXYPHENYL)ACETAMIDE
445288095
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)CNC3=CC=C(C=C3)Cl
InChI=1SC22H24ClN5O2Sc13132820(1424177516(23)6817)262722(28)311521(29)251891119(121018)3042h351224H141315H22H3(H2529)
MFCD01614654
ZINC000000673492
ZINC00673492
ZINC673492
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