Vitas-M small molecule compound

2-(3-nitrophenyl)-3-[5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3,4-thiadiazol-2-yl]-1,3-thiazolidin-4-one

Catalog ID
STK384624
SMILES O=C1CSC(N1c1nnc(s1)C12CC3CC(C2)CC(C1)C3)c1cccc(c1)[N+](=O)[O-]

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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 C21H22N4O3S2 MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S2/c26-17-11-29-18(15-2-1-3-16(7-15)25(27)28)24(17)20-23-22-19(30-20)21-8-12-4-13(9-21)6-14(5-12)10-21/h1-3,7,12-14,18H,4-6,8-11H2
InChIKey
JKWKHPJXWQBRNU-UHFFFAOYSA-N
Synonyms

2(3nitrophenyl)3(5(tricyclo(3311~37~)dec1yl)134thiadiazol2yl)13thiazolidin4one
3(5(1ADAMANTYL)134THIADIAZOL2YL)2(3NITROPHENYL)13THIAZOLIDIN4ONE
3(5ADAMANTANYL(134THIADIAZOL2YL))2(3NITROPHENYL)13THIAZOLIDIN4ONE
C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)N5C(SCC5=O)C6=CC(=CC=C6)(N+)(=O)(O)
InChI=1SC21H22N4O3S2c2617112918(1521316(715)25(27)28)24(17)20232219(3020)21812413(921)614(512)1021h137121418H46811H2
MFCD04966739
O=C1CSC(N1c1nnc(s1)C12CC3CC(C2)CC(C1)C3)c1cccc(c1)(N+)(=O)(O)
ZINC000015947184
ZINC000015947186

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Available files

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