Vitas-M small molecule compound
N-(3-chloro-4-fluorophenyl)-6-(4-ethoxyphenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL360072
SMILES CCCc1nnc2n1NC(c1ccc(cc1)OCC)C(S2)C(=O)Nc1ccc(c(c1)Cl)F
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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 C22H23ClFN5O2S MW 475.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClFN5O2S/c1-3-5-18-26-27-22-29(18)28-19(13-6-9-15(10-7-13)31-4-2)20(32-22)21(30)25-14-8-11-17(24)16(23)12-14/h6-12,19-20,28H,3-5H2,1-2H3,(H,25,30)InChIKey
QTWHLKILCITPDR-UHFFFAOYSA-NSynonyms
CCCC1=NN=C2N1NC(C(S2)C(=O)NC3=CC(=C(C=C3)F)Cl)C4=CC=C(C=C4)OCC
InChI=1SC22H23ClFN5O2Sc1351826272229(18)2819(136915(10713)3142)20(3222)21(30)251481117(24)16(23)1214h612192028H35H212H3(H2530)
MFCD08111646
N(3chloro4fluorophenyl)6(4ethoxyphenyl)3propyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009239470
ZINC000009239475
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