Vitas-M small molecule compound

N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methylbenzamide

Catalog ID
STK023007
SMILES S=C(Nc1ccc2c3c1cccc3CC2)NC(=O)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 C21H18N2OS MW 346.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2OS/c1-13-5-7-16(8-6-13)20(24)23-21(25)22-18-12-11-15-10-9-14-3-2-4-17(18)19(14)15/h2-8,11-12H,9-10H2,1H3,(H2,22,23,24,25)
InChIKey
FRQBVMCUIBXXBE-UHFFFAOYSA-N
Synonyms
6427-34-5
1ACENAPHTHEN5YL3(4METHYLBENZOYL)THIOUREA
3(12DIHYDROACENAPHTHYLEN5YL)1(4METHYLBENZOYL)THIOUREA
6427345
BENZAMIDEN(((12DIHYDRO5ACENAPHTHYLENYL)AMINO)THIOXOMETHYL)4METHYL
CC1=CC=C(C=C1)C(=O)NC(=S)NC2=C3C=CC=C4C3=C(CC4)C=C2
InChI=1SC21H18N2OSc1135716(8613)20(24)2321(25)22181211151091432417(18)19(14)15h281112H910H21H3(H222232425)
MFCD02625330
N(12DIHYDROACENAPHTHYLEN5YL)N(4METHYLBENZOYL)THIOUREA
N(12DIHYDROACENAPHTHYLEN5YLCARBAMOTHIOYL)4METHYLBENZAMIDE
S=C(Nc1ccc2c3c1cccc3CC2)NC(=O)c1ccc(cc1)C
STK023007
ZINC000000309377
ZINC00309377
ZINC309377

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Available files

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