Vitas-M small molecule compound
4-imino-5-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-sulfanyl-3-azaspiro[5.5]undec-1-ene-1-carbonitrile
Catalog ID
STK523281
SMILES N#CC1=C(S)NC(=N)C(C21CCCCC2)c1scc(n1)c1ccc(cc1)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 C21H22N4S2 MW 394.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4S2/c1-13-5-7-14(8-6-13)16-12-27-20(24-16)17-18(23)25-19(26)15(11-22)21(17)9-3-2-4-10-21/h5-8,12,17,26H,2-4,9-10H2,1H3,(H2,23,25)InChIKey
QGXCRUVIXCXSER-UHFFFAOYSA-NSynonyms
2amino1(4(4methylphenyl)13thiazol2yl)4sulfanyl3azaspiro(55)undeca24diene5carbonitrile
4imino5(4(4methylphenyl)13thiazol2yl)2sulfanyl3azaspiro(55)undec1ene1carbonitrile
8AMINO7(4(4METHYLPHENYL)13THIAZOL2YL)10SULFANYL9AZASPIRO(55)UNDECA810DIENE11CARBONITRILE
CC1=CC=C(C=C1)C2=CSC(=N2)C3C(=NC(=C(C34CCCCC4)C#N)S)N
InChI=1SC21H22N4S2c1135714(8613)16122720(2416)1718(23)2519(26)15(1122)21(17)93241021h58121726H24910H21H3(H22325)
MFCD02712996
ZINC000005409123
ZINC000005442990
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