Vitas-M small molecule compound
diprop-2-en-1-yl 7-(4-tert-butylphenyl)-9-hydroxy-9-methyl-3-thioxo-1,2,4-triazaspiro[4.5]decane-6,8-dicarboxylate
Catalog ID
STK688481
SMILES C=CCOC(=O)C1C(c2ccc(cc2)C(C)(C)C)C(C(=O)OCC=C)C2(CC1(C)O)NNC(=S)N2
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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 C26H35N3O5S MW 501.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35N3O5S/c1-7-13-33-21(30)19-18(16-9-11-17(12-10-16)24(3,4)5)20(22(31)34-14-8-2)26(15-25(19,6)32)27-23(35)28-29-26/h7-12,18-20,29,32H,1-2,13-15H2,3-6H3,(H2,27,28,35)InChIKey
USHMZOYLGMPHSA-UHFFFAOYSA-NSynonyms
bis(prop2enyl)7(4tertbutylphenyl)9hydroxy9methyl3sulfanylidene124triazaspiro(45)decane68dicarboxylate
BIS(PROP2ENYL)9(4TERTBUTYLPHENYL)7HYDROXY7METHYL2SULFANYLIDENE134TRIAZASPIRO(45)DECANE810DICARBOXYLATE
CC1(CC2(C(C(C1C(=O)OCC=C)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC=C)NC(=S)NN2)O
diprop2en1yl7(4tertbutylphenyl)9hydroxy9methyl3thioxo124triazaspiro(45)decane68dicarboxylate
InChI=1SC26H35N3O5Sc17133321(30)1918(1691117(121016)24(34)5)20(22(31)341482)26(1525(196)32)2723(35)282926h71218202932H121315H236H3(H2272835)
MFCD07657692
ZINC000217740798
ZINC000245256964
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