Vitas-M small molecule compound
N-{1-[5-({2-[(2,4-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-2-methylpropyl}-3-methylbenzamide
Catalog ID
STK142032
SMILES O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1C)C(C(C)C)NC(=O)c1cccc(c1)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 C23H25Cl2N5O2S MW 506.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25Cl2N5O2S/c1-13(2)20(27-22(32)15-7-5-6-14(3)10-15)21-28-29-23(30(21)4)33-12-19(31)26-18-9-8-16(24)11-17(18)25/h5-11,13,20H,12H2,1-4H3,(H,26,31)(H,27,32)InChIKey
DMYNXEHRMMJCQZ-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NC(C2=NN=C(N2C)SCC(=O)NC3=C(C=C(C=C3)Cl)Cl)C(C)C
InChI=1SC23H25Cl2N5O2Sc113(2)20(2722(32)1575614(3)1015)21282923(30(21)4)331219(31)26189816(24)1117(18)25h5111320H12H214H3(H2631)(H2732)
MFCD03785018
N(1(5((2((24DICHLOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)2METHYLPROPYL)3METHYLBENZAMIDE
N(1(5((2(24DICHLOROANILINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)2METHYLPROPYL)3METHYLBENZAMIDE
N(1(5(2(24DICHLOROANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)2METHYLPROPYL)3METHYLBENZAMIDE
ZINC000000686469
ZINC000000686470
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