Vitas-M small molecule compound
N-{1-[5-({2-[(2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}-4-methylbenzamide
Catalog ID
STK140778
SMILES O=C(Nc1ccccc1F)CSc1nnc(n1C)C(NC(=O)c1ccc(cc1)C)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 C21H22FN5O2S MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN5O2S/c1-13-8-10-15(11-9-13)20(29)23-14(2)19-25-26-21(27(19)3)30-12-18(28)24-17-7-5-4-6-16(17)22/h4-11,14H,12H2,1-3H3,(H,23,29)(H,24,28)InChIKey
UPVCSBYISGUQDB-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(=O)NC(C)C2=NN=C(N2C)SCC(=O)NC3=CC=CC=C3F
InChI=1SC21H22FN5O2Sc11381015(11913)20(29)2314(2)19252621(27(19)3)301218(28)2417754616(17)22h41114H12H213H3(H2329)(H2428)
MFCD03996723
N(1(5((2((2FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)ETHYL)4METHYLBENZAMIDE
N(1(5((2(2FLUOROANILINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)ETHYL)4METHYLBENZAMIDE
N(1(5(2(2FLUOROANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)ETHYL)4METHYLBENZAMIDE
ZINC000000669183
ZINC000000669185
ZINC00669183
ZINC00669185
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