Vitas-M small molecule compound
2-chloro-N-({4-ethyl-5-[(2-{[3-(methylsulfanyl)phenyl]amino}-2-oxoethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)benzamide
Catalog ID
STK140011
SMILES CSc1cccc(c1)NC(=O)CSc1nnc(n1CC)CNC(=O)c1ccccc1Cl
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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 C21H22ClN5O2S2 MW 476.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5O2S2/c1-3-27-18(12-23-20(29)16-9-4-5-10-17(16)22)25-26-21(27)31-13-19(28)24-14-7-6-8-15(11-14)30-2/h4-11H,3,12-13H2,1-2H3,(H,23,29)(H,24,28)InChIKey
QVEVXRDSCKKZJC-UHFFFAOYSA-NSynonyms
2CHLORON((4ETHYL5((2((3(METHYLSULFANYL)PHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
2CHLORON((4ETHYL5(2(3METHYLSULFANYLANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)METHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)SC)CNC(=O)C3=CC=CC=C3Cl
InChI=1SC21H22ClN5O2S2c132718(122320(29)169451017(16)22)252621(27)311319(28)241476815(1114)302h411H31213H212H3(H2329)(H2428)
MFCD04213412
ZINC000002841573
ZINC02841573
ZINC2841573
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