Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-[(5-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanamide
Catalog ID
STK221853
SMILES Fc1ccc(cc1)NC(=O)Cc1nnc(n1C)SC(C(=O)Nc1ccc2c(c1)OCO2)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 C21H20FN5O4S MW 457.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN5O4S/c1-12(20(29)24-15-7-8-16-17(9-15)31-11-30-16)32-21-26-25-18(27(21)2)10-19(28)23-14-5-3-13(22)4-6-14/h3-9,12H,10-11H2,1-2H3,(H,23,28)(H,24,29)InChIKey
SHNMIENSGLFLPB-UHFFFAOYSA-NSynonyms
CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NN=C(N3C)CC(=O)NC4=CC=C(C=C4)F
InChI=1SC21H20FN5O4Sc112(20(29)2415781617(915)31113016)3221262518(27(21)2)1019(28)23145313(22)4614h3912H1011H212H3(H2328)(H2429)
MFCD07401435
N(13BENZODIOXOL5YL)2((5(2((4FLUOROPHENYL)AMINO)2OXOETHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)PROPANAMIDE
N(13BENZODIOXOL5YL)2((5(2(4FLUOROANILINO)2OXOETHYL)4METHYL124TRIAZOL3YL)SULFANYL)PROPANAMIDE
ZINC000009264079
ZINC000009264080
Check stock
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