Vitas-M small molecule compound

8-chloro-3-(4-methoxyphenyl)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one

Catalog ID
STK681886
SMILES COc1ccc(cc1)n1nnc2c(c1=O)sc1c2c(C)c(c(n1)C)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 C17H13ClN4O2S MW 372.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4O2S/c1-8-12-14-15(25-16(12)19-9(2)13(8)18)17(23)22(21-20-14)10-4-6-11(24-3)7-5-10/h4-7H,1-3H3
InChIKey
MYNZCAWKGSCLRN-UHFFFAOYSA-N
Synonyms

8chloro3(4methoxyphenyl)79dimethylpyrido(12)thieno(34b)triazin4one
8chloro3(4methoxyphenyl)79dimethylpyrido(3245)thieno(32d)(123)triazin4(3H)one
CC1=C2C3=C(C(=O)N(N=N3)C4=CC=C(C=C4)OC)SC2=NC(=C1Cl)C
InChI=1SC17H13ClN4O2Sc18121415(2516(12)199(2)13(8)18)17(23)22(212014)104611(243)7510h47H13H3
MFCD03820541
ZINC000004581407
ZINC04581407
ZINC4581407

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Available files

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