Vitas-M small molecule compound
2-fluoro-N-{2-[5-({2-[(4-methyl-3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK186726
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])C)nnc1CCNC(=O)c1ccccc1F
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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 C23H23FN6O4S MW 498.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23FN6O4S/c1-3-12-29-20(10-11-25-22(32)17-6-4-5-7-18(17)24)27-28-23(29)35-14-21(31)26-16-9-8-15(2)19(13-16)30(33)34/h3-9,13H,1,10-12,14H2,2H3,(H,25,32)(H,26,31)InChIKey
OUUXWZUBCJLLQM-UHFFFAOYSA-NSynonyms
2FLUORON(2(5((2((4METHYL3NITROPHENYL)AMINO)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
2FLUORON(2(5(2(4METHYL3NITROANILINO)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)ETHYL)BENZAMIDE
C=CCn1c(SCC(=O)Nc2ccc(c(c2)(N+)(=O)(O))C)nnc1CCNC(=O)c1ccccc1F
CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)CCNC(=O)C3=CC=CC=C3F)(N+)(=O)(O)
InChI=1SC23H23FN6O4Sc13122920(10112522(32)17645718(17)24)272823(29)351421(31)26169815(2)19(1316)30(33)34h3913H1101214H22H3(H2532)(H2631)
MFCD05998927
ZINC000009262140
ZINC09262140
ZINC9262140
Check stock
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