Vitas-M small molecule compound
5-(4-tert-butylphenyl)-3-[2-(naphthalen-2-yl)-2-oxoethyl]-1,3,4-thiadiazol-2(3H)-iminium
Catalog ID
STK059254
SMILES O=C(c1ccc2c(c1)cccc2)Cn1nc(sc1=[NH2+])c1ccc(cc1)C(C)(C)C
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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 C24H24N3OS MW 402.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3OS/c1-24(2,3)20-12-10-17(11-13-20)22-26-27(23(25)29-22)15-21(28)19-9-8-16-6-4-5-7-18(16)14-19/h4-14,25H,15H2,1-3H3/p+1InChIKey
BKRKCPYPLQJTPO-UHFFFAOYSA-OSynonyms
2(2AMINO5(4TERTBUTYLPHENYL)134THIADIAZOL3IUM3YL)1NAPHTHALEN2YLETHANONE
5(4TERTBUTYLPHENYL)3(2(NAPHTHALEN2YL)2OXOETHYL)134THIADIAZOL2(3H)IMINIUM
CC(C)(C)C1=CC=C(C=C1)C2=N(N+)(=C(S2)N)CC(=O)C3=CC4=CC=CC=C4C=C3
InChI=1SC24H23N3OSc124(23)20121017(111320)222627(23(25)2922)1521(28)199816645718(16)1419h41425H15H213H3p+1
O=C(c1ccc2c(c1)cccc2)Cn1nc(sc1=(NH2+))c1ccc(cc1)C(C)(C)C
STK059254
ZINC000009553394
ZINC06212345
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