Vitas-M small molecule compound

N~1~-(4-chlorophenyl)-2-methyl-4-thioxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarboxamide

Catalog ID
STL340834
SMILES O=C(C1=C(C)NC(=S)C(C21CCCCC2)C(=O)N)Nc1ccc(cc1)Cl

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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 C19H22ClN3O2S MW 391.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClN3O2S/c1-11-14(17(25)23-13-7-5-12(20)6-8-13)19(9-3-2-4-10-19)15(16(21)24)18(26)22-11/h5-8,15H,2-4,9-10H2,1H3,(H2,21,24)(H,22,26)(H,23,25)
InChIKey
FALPMKIMEMJFAT-UHFFFAOYSA-N
Synonyms
577998-89-1
(5S)N1(4CHLOROPHENYL)2METHYL4THIOXO3AZASPIRO(55)UNDEC1ENE15DICARBOXAMIDE
11N(4CHLOROPHENYL)10METHYL8SULFANYLIDENE9AZASPIRO(55)UNDEC10ENE711DICARBOXAMIDE
2METHYL4THIOXO3AZASPIRO(55)UNDEC1ENE15DICARBOXYLICACID5AMIDE1((4CHLOROPHENYL)AMIDE)
577998891
5N(4chlorophenyl)4methyl2sulfanylidene3azaspiro(55)undec4ene15dicarboxamide
CC1=C(C2(CCCCC2)C(C(=S)N1)C(=O)N)C(=O)NC3=CC=C(C=C3)Cl
InChI=1SC19H22ClN3O2Sc11114(17(25)23137512(20)6813)19(93241019)15(16(21)24)18(26)2211h5815H24910H21H3(H22124)(H2226)(H2325)
MFCD04022744
N~1~(4chlorophenyl)2methyl4thioxo3azaspiro(55)undec1ene15dicarboxamide
N1(4CHLOROPHENYL)2METHYL4THIOXO3AZASPIRO(55)UNDEC1ENE15DICARBOXAMIDE
ZINC000002361818
ZINC000004304054

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Available files

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