Vitas-M small molecule compound

ethyl 3,9-bis(4-chlorophenyl)-7-methyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazine-8-carboxylate

Catalog ID
STK687438
SMILES CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)Cl)c1nnn(c(=O)c1s2)c1ccc(cc1)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 C24H16Cl2N4O3S MW 511.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16Cl2N4O3S/c1-3-33-24(32)17-12(2)27-22-19(18(17)13-4-6-14(25)7-5-13)20-21(34-22)23(31)30(29-28-20)16-10-8-15(26)9-11-16/h4-11H,3H2,1-2H3
InChIKey
KZDPHRFJTVYZRN-UHFFFAOYSA-N
Synonyms
CCOC(=O)C1=C(N=C2C(=C1C3=CC=C(C=C3)Cl)C4=C(S2)C(=O)N(N=N4)C5=CC=C(C=C5)Cl)C
ethyl39bis(4chlorophenyl)7methyl4oxo34dihydropyrido(3245)thieno(32d)(123)triazine8carboxylate
ethyl39bis(4chlorophenyl)7methyl4oxopyrido(12)thieno(34b)triazine8carboxylate
Registry IDs
MFCD06618808
ZINC000012413777
ZINC12413777

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Available files

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