Vitas-M small molecule compound
N-{[5-({2-[(3-chloro-4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-3-methylbenzamide
Catalog ID
STK136000
SMILES O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1C)CNC(=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 C20H19ClFN5O2S MW 447.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClFN5O2S/c1-12-4-3-5-13(8-12)19(29)23-10-17-25-26-20(27(17)2)30-11-18(28)24-14-6-7-16(22)15(21)9-14/h3-9H,10-11H2,1-2H3,(H,23,29)(H,24,28)InChIKey
OQLZDZYROKXYFY-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2C)SCC(=O)NC3=CC(=C(C=C3)F)Cl
InChI=1SC20H19ClFN5O2Sc11243513(812)19(29)231017252620(27(17)2)301118(28)24146716(22)15(21)914h39H1011H212H3(H2329)(H2428)
MFCD04345260
N((5((2((3CHLORO4FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)3METHYLBENZAMIDE
N((5(2(3CHLORO4FLUOROANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)3METHYLBENZAMIDE
N(5((3CHLORO4FLUOROPHENYLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YLMETHYL)3METHYLBENZAMIDE
ZINC000001112668
ZINC01112668
ZINC1112668
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