Vitas-M small molecule compound

7-ethyl 3-methyl 1-(4-bromophenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate

Catalog ID
STL005439
SMILES CCOC(=O)C1=C(C)N(C2(S1)SC(=NN2c1ccc(cc1)Br)C(=O)OC)c1ccccc1

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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 C22H20BrN3O4S2 MW 534.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O4S2/c1-4-30-20(27)18-14(2)25(16-8-6-5-7-9-16)22(31-18)26(17-12-10-15(23)11-13-17)24-19(32-22)21(28)29-3/h5-13H,4H2,1-3H3
InChIKey
BLJDBLKTRJPTMY-UHFFFAOYSA-N
Synonyms
670263-75-9
3OETHYL8OMETHYL6(4BROMOPHENYL)2METHYL1PHENYL49DITHIA167TRIAZASPIRO(44)NONA27DIENE38DICARBOXYLATE
670263759
7ETHYL3METHYL(5S)1(4BROMOPHENYL)8METHYL9PHENYL46DITHIA129TRIAZASPIRO(44)NONA27DIENE37DICARBOXYLATE
7ethyl3methyl1(4bromophenyl)8methyl9phenyl46dithia129triazaspiro(44)nona27diene37dicarboxylate
7Oethyl2Omethyl4(4bromophenyl)8methyl9phenyl16dithia349triazaspiro(44)nona27diene27dicarboxylate
CCOC(=O)C1=C(N(C2(S1)N(N=C(S2)C(=O)OC)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C
InChI=1SC22H20BrN3O4S2c143020(27)1814(2)25(168657916)22(3118)26(17121015(23)111317)2419(3222)21(28)293h513H4H213H3
MFCD03670798
ZINC000002202671
ZINC000002202672

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Available files

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