Vitas-M small molecule compound

ethyl 1-{3-[(4-ethylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl}piperidine-4-carboxylate

Catalog ID
STL085948
SMILES CCOC(=O)C1CCN(CC1)c1nc2n(c3c1scc3)nnc2S(=O)(=O)c1ccc(cc1)CC

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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 C23H25N5O4S2 MW 499.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O4S2/c1-3-15-5-7-17(8-6-15)34(30,31)22-21-24-20(19-18(11-14-33-19)28(21)26-25-22)27-12-9-16(10-13-27)23(29)32-4-2/h5-8,11,14,16H,3-4,9-10,12-13H2,1-2H3
InChIKey
HKGWNQCNDFIDNG-UHFFFAOYSA-N
Synonyms
892742-93-7
892742937
CCC1=CC=C(C=C1)S(=O)(=O)C2=C3N=C(C4=C(N3N=N2)C=CS4)N5CCC(CC5)C(=O)OCC
ethyl1(3((4ethylphenyl)sulfonyl)thieno(23e)(123)triazolo(15a)pyrimidin5yl)piperidine4carboxylate
InChI=1SC23H25N5O4S2c13155717(8615)34(3031)22212420(1918(11143319)28(21)262522)2712916(101327)23(29)3242h58111416H349101213H212H3
MFCD06744301
ZINC000009970943
ZINC09970943
ZINC9970943

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Available files

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