Vitas-M small molecule compound
4-{(4Z)-4-[(2,6-dimethylphenyl)imino]-2-thioxo-1,3-diazaspiro[4.5]dec-1-yl}benzoic acid
Catalog ID
STK018917
SMILES S=C1N/C(=N\c2c(C)cccc2C)/C2(N1c1ccc(cc1)C(=O)O)CCCCC2
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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 C23H25N3O2S MW 407.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O2S/c1-15-7-6-8-16(2)19(15)24-21-23(13-4-3-5-14-23)26(22(29)25-21)18-11-9-17(10-12-18)20(27)28/h6-12H,3-5,13-14H2,1-2H3,(H,27,28)(H,24,25,29)InChIKey
CWPRRUGGKMFAKC-UHFFFAOYSA-NSynonyms
4((4Z)4((26DIMETHYLPHENYL)IMINO)2THIOXO13DIAZASPIRO(45)DEC1YL)BENZOICACID
4(1(26DIMETHYLANILINO)3SULFANYLIDENE24DIAZASPIRO(45)DEC1EN4YL)BENZOICACID
4(4((26DIMETHYLPHENYL)IMINO)2THIOXO13DIAZASPIRO(45)DEC1YL)BENZOICACID
4(4(26dimethylanilino)2sulfanylidene13diazaspiro(45)dec3en1yl)benzoicacid
CC1=C(C(=CC=C1)C)NC2=NC(=S)N(C23CCCCC3)C4=CC=C(C=C4)C(=O)O
InChI=1SC23H25N3O2Sc11576816(2)19(15)242123(134351423)26(22(29)2521)1811917(101218)20(27)28h612H351314H212H3(H2728)(H242529)
MFCD01929532
S=C1NC(=Nc2c(C)cccc2C)C2(N1c1ccc(cc1)C(=O)O)CCCCC2
STK018917
ZINC000002181983
ZINC2181983
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