Vitas-M small molecule compound
azepan-1-yl[6-(4-chlorophenyl)-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]methanone
Catalog ID
STL359115
SMILES Clc1ccc(cc1)C1Nn2c(SC1C(=O)N1CCCCCC1)nnc2c1ccccc1
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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 C23H24ClN5OS MW 454.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClN5OS/c24-18-12-10-16(11-13-18)19-20(22(30)28-14-6-1-2-7-15-28)31-23-26-25-21(29(23)27-19)17-8-4-3-5-9-17/h3-5,8-13,19-20,27H,1-2,6-7,14-15H2InChIKey
IHUMYSMRVYUZFP-UHFFFAOYSA-NSynonyms
azepan1yl(6(4chlorophenyl)3phenyl67dihydro5H(124)triazolo(34b)(134)thiadiazin7yl)methanone
C1CCCN(CC1)C(=O)C2C(NN3C(=NN=C3S2)C4=CC=CC=C4)C5=CC=C(C=C5)Cl
InChI=1SC23H24ClN5OSc2418121016(111318)1920(22(30)281461271528)3123262521(29(23)2719)178435917h35813192027H12671415H2
MFCD08098710
ZINC000009238813
ZINC000009238816
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