Vitas-M small molecule compound
3,4-dichloro-N-{[5-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Catalog ID
STK133812
SMILES C=CCn1c(SCC(=O)Nc2cccc(c2)OC)nnc1CNC(=O)c1ccc(c(c1)Cl)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 C22H21Cl2N5O3S MW 506.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21Cl2N5O3S/c1-3-9-29-19(12-25-21(31)14-7-8-17(23)18(24)10-14)27-28-22(29)33-13-20(30)26-15-5-4-6-16(11-15)32-2/h3-8,10-11H,1,9,12-13H2,2H3,(H,25,31)(H,26,30)InChIKey
SDYKAMNWZWBRLH-UHFFFAOYSA-NSynonyms
34DICHLORON((5((2((3METHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
34DICHLORON((5(2(3METHOXYANILINO)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)METHYL)BENZAMIDE
COC1=CC=CC(=C1)NC(=O)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC22H21Cl2N5O3Sc1392919(122521(31)147817(23)18(24)1014)272822(29)331320(30)261554616(1115)322h381011H191213H22H3(H2531)(H2630)
MFCD04336884
ZINC000001113180
ZINC01113180
ZINC1113180
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