Vitas-M small molecule compound
N-({5-[(2-{[4-iodo-2-(propan-2-yl)phenyl]amino}-2-oxoethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}methyl)-4-methylbenzamide
Catalog ID
STK143714
SMILES O=C(Nc1ccc(cc1C(C)C)I)CSc1nnc(n1C)CNC(=O)c1ccc(cc1)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 C23H26IN5O2S MW 563.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26IN5O2S/c1-14(2)18-11-17(24)9-10-19(18)26-21(30)13-32-23-28-27-20(29(23)4)12-25-22(31)16-7-5-15(3)6-8-16/h5-11,14H,12-13H2,1-4H3,(H,25,31)(H,26,30)InChIKey
KMCUYUXKERUEBI-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C)SCC(=O)NC3=C(C=C(C=C3)I)C(C)C
InChI=1SC23H26IN5O2Sc114(2)181117(24)91019(18)2621(30)133223282720(29(23)4)122522(31)167515(3)6816h51114H1213H214H3(H2531)(H2630)
MFCD04090046
N((5((2((4IODO2(PROPAN2YL)PHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)4METHYLBENZAMIDE
N((5((2(4IODO2ISOPROPYLANILINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)4METHYLBENZAMIDE
N((5(2(4IODO2PROPAN2YLANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)4METHYLBENZAMIDE
ZINC000008461794
ZINC08461794
ZINC8461794
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