Vitas-M small molecule compound
3-ethyl 7-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
STL005529
SMILES CCOC(=O)C1=NN(C2(S1)SC(=C(N2c1ccccc1)C)C(=O)OC)c1ccc(cc1)Br
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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/c1-4-30-21(28)19-24-26(17-12-10-15(23)11-13-17)22(32-19)25(16-8-6-5-7-9-16)14(2)18(31-22)20(27)29-3/h5-13H,4H2,1-3H3InChIKey
SPAPHJCPQUYDON-UHFFFAOYSA-NSynonyms
670263-46-42Oethyl7Omethyl4(4bromophenyl)8methyl9phenyl16dithia349triazaspiro(44)nona27diene27dicarboxylate
3ethyl7methyl1(4bromophenyl)8methyl9phenyl46dithia129triazaspiro(44)nona27diene37dicarboxylate
670263464
8OETHYL3OMETHYL6(4BROMOPHENYL)2METHYL1PHENYL49DITHIA167TRIAZASPIRO(44)NONA27DIENE38DICARBOXYLATE
CCOC(=O)C1=NN(C2(S1)N(C(=C(S2)C(=O)OC)C)C3=CC=CC=C3)C4=CC=C(C=C4)Br
InChI=1SC22H20BrN3O4S2c143021(28)192426(17121015(23)111317)22(3219)25(168657916)14(2)18(3122)20(27)293h513H4H213H3
MFCD04222975
ZINC000002447530
ZINC000002447531
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