Vitas-M small molecule compound
4-chloro-N-(2-methyl-1-{4-methyl-5-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}propyl)benzamide
Catalog ID
STK114805
SMILES O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1C)C(C(C)C)NC(=O)c1ccc(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 C23H23ClF3N5O2S MW 525.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClF3N5O2S/c1-13(2)19(29-21(34)14-7-9-16(24)10-8-14)20-30-31-22(32(20)3)35-12-18(33)28-17-6-4-5-15(11-17)23(25,26)27/h4-11,13,19H,12H2,1-3H3,(H,28,33)(H,29,34)InChIKey
SEUMOAUHOHRJCO-UHFFFAOYSA-NSynonyms
4CHLORON(2METHYL1(4METHYL5((2OXO2((3(TRIFLUOROMETHYL)PHENYL)AMINO)ETHYL)SULFANYL)4H124TRIAZOL3YL)PROPYL)BENZAMIDE
4CHLORON(2METHYL1(4METHYL5(2OXO2(3(TRIFLUOROMETHYL)ANILINO)ETHYL)SULFANYL124TRIAZOL3YL)PROPYL)BENZAMIDE
CC(C)C(C1=NN=C(N1C)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)NC(=O)C3=CC=C(C=C3)Cl
InChI=1SC23H23ClF3N5O2Sc113(2)19(2921(34)147916(24)10814)20303122(32(20)3)351218(33)281764515(1117)23(2526)27h4111319H12H213H3(H2833)(H2934)
MFCD04128532
ZINC000001129496
ZINC000001129498
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