Vitas-M small molecule compound

ethyl 1-(4-methylphenyl)-4-oxo-2-thioxo-1,3-diazaspiro[4.5]decane-3-carboxylate

Catalog ID
STK014778
SMILES CCOC(=O)N1C(=S)N(C2(C1=O)CCCCC2)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 C18H22N2O3S MW 346.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O3S/c1-3-23-17(22)19-15(21)18(11-5-4-6-12-18)20(16(19)24)14-9-7-13(2)8-10-14/h7-10H,3-6,11-12H2,1-2H3
InChIKey
MOGFXVAPEOTVNG-UHFFFAOYSA-N
Synonyms

1(4METHYLPHENYL)4OXO2SULFANYLIDENE13DIAZASPIRO(45)DECANE3CARBOXYLICACIDETHYLESTER
4KETO1(PTOLYL)2THIOXO13DIAZASPIRO(45)DECANE3CARBOXYLICACIDETHYLESTER
CCOC(=O)N1C(=O)C2(CCCCC2)N(C1=S)C3=CC=C(C=C3)C
CCOC(=O)N1C(=S)N(C2(C1=O)CCCCC2)c1ccc(cc1)C
ETHYL1(4METHYLPHENYL)4OXIDANYLIDENE2SULFANYLIDENE13DIAZASPIRO(45)DECANE3CARBOXYLATE
ETHYL1(4METHYLPHENYL)4OXO2SULFANYLIDENE13DIAZASPIRO(45)DECANE3CARBOXYLATE
ETHYL1(4METHYLPHENYL)4OXO2THIOXO13DIAZASPIRO(45)DECANE3CARBOXYLATE
ETHYL4(4METHYLPHENYL)1OXO3SULFANYLIDENE24DIAZASPIRO(45)DECANE2CARBOXYLATE
InChI=1SC18H22N2O3Sc132317(22)1915(21)18(115461218)20(16(19)24)149713(2)81014h710H361112H212H3
MFCD02325013
STK014778
ZINC000004560434
ZINC04560434
ZINC4560434

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.