Vitas-M small molecule compound

3-(3-chlorophenyl)-6-(4-ethoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

Catalog ID
STK556254
SMILES CCOc1ccc(cc1)C1=Nn2c(SC1)nnc2c1cccc(c1)Cl

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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 C18H15ClN4OS MW 370.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN4OS/c1-2-24-15-8-6-12(7-9-15)16-11-25-18-21-20-17(23(18)22-16)13-4-3-5-14(19)10-13/h3-10H,2,11H2,1H3
InChIKey
NDAWMGUSZCGPJZ-UHFFFAOYSA-N
Synonyms
843625-96-7
1(3(3CHLOROPHENYL)(7H124TRIAZOLO(34B)134THIADIAZIN6YL))4ETHOXYBENZENE
3(3chlorophenyl)6(4ethoxyphenyl)7H(124)triazolo(34b)(134)thiadiazine
843625967
CCOC1=CC=C(C=C1)C2=NN3C(=NN=C3SC2)C4=CC(=CC=C4)Cl
InChI=1SC18H15ClN4OSc1224158612(7915)16112518212017(23(18)2216)1343514(19)1013h310H211H21H3
MFCD04016726
ZINC000005047073
ZINC05047073
ZINC5047073

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.