Vitas-M small molecule compound
2-chloro-N-(1-{4-methyl-5-[(2-{[3-(morpholin-4-ylcarbonyl)phenyl]amino}-2-oxoethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}ethyl)benzamide
Catalog ID
STL122914
SMILES O=C(Nc1cccc(c1)C(=O)N1CCOCC1)CSc1nnc(n1C)C(NC(=O)c1ccccc1Cl)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 C25H27ClN6O4S MW 543.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27ClN6O4S/c1-16(27-23(34)19-8-3-4-9-20(19)26)22-29-30-25(31(22)2)37-15-21(33)28-18-7-5-6-17(14-18)24(35)32-10-12-36-13-11-32/h3-9,14,16H,10-13,15H2,1-2H3,(H,27,34)(H,28,33)InChIKey
YCUSEPLZDAVCLA-UHFFFAOYSA-NSynonyms
2chloroN(1(4methyl5((2((3(morpholin4ylcarbonyl)phenyl)amino)2oxoethyl)sulfanyl)4H124triazol3yl)ethyl)benzamide
2CHLORON(1(4METHYL5(2(3(MORPHOLINE4CARBONYL)ANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CC(C1=NN=C(N1C)SCC(=O)NC2=CC=CC(=C2)C(=O)N3CCOCC3)NC(=O)C4=CC=CC=C4Cl
InChI=1SC25H27ClN6O4Sc116(2723(34)19834920(19)26)22293025(31(22)2)371521(33)281875617(1418)24(35)32101236131132h391416H101315H212H3(H2734)(H2833)
MFCD05991934
ZINC000059603495
ZINC000059603496
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