Vitas-M small molecule compound
3-[({[5-(1-{[(4-chlorophenyl)carbonyl]amino}-3-methylbutyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STL183084
SMILES CC(CC(c1nnc(n1C)SCC(=O)Nc1cccc(c1)C(=O)O)NC(=O)c1ccc(cc1)Cl)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 C24H26ClN5O4S MW 516.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClN5O4S/c1-14(2)11-19(27-22(32)15-7-9-17(25)10-8-15)21-28-29-24(30(21)3)35-13-20(31)26-18-6-4-5-16(12-18)23(33)34/h4-10,12,14,19H,11,13H2,1-3H3,(H,26,31)(H,27,32)(H,33,34)InChIKey
XLRHVZPETKYVLW-UHFFFAOYSA-NSynonyms
3((((5(1(((4chlorophenyl)carbonyl)amino)3methylbutyl)4methyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
3((2((5(1((4chlorobenzoyl)amino)3methylbutyl)4methyl124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
CC(C)CC(C1=NN=C(N1C)SCC(=O)NC2=CC=CC(=C2)C(=O)O)NC(=O)C3=CC=C(C=C3)Cl
InChI=1SC24H26ClN5O4Sc114(2)1119(2722(32)157917(25)10815)21282924(30(21)3)351320(31)261864516(1218)23(33)34h410121419H1113H213H3(H2631)(H2732)(H3334)
MFCD22125465
ZINC000072191540
ZINC000072191541
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