Vitas-M small molecule compound

2-oxo-2-[2,2,4,6-tetramethyl-4-(4-methylphenyl)-3,4-dihydroquinolin-1(2H)-yl]ethyl thiocyanate

Catalog ID
STK017510
SMILES N#CSCC(=O)N1c2ccc(cc2C(CC1(C)C)(C)c1ccc(cc1)C)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 C23H26N2OS MW 378.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2OS/c1-16-6-9-18(10-7-16)23(5)14-22(3,4)25(21(26)13-27-15-24)20-11-8-17(2)12-19(20)23/h6-12H,13-14H2,1-5H3
InChIKey
MPDFZCVQDFLGAO-UHFFFAOYSA-N
Synonyms

(2oxo2(2246tetramethyl4(4methylphenyl)3Hquinolin1yl)ethyl)thiocyanate
1(2246tetramethyl4(ptolyl)34dihydroquinolin1(2H)yl)2thiocyanatoethanone
2oxo2(2246tetramethyl4(4methylphenyl)34dihydroquinolin1(2H)yl)ethylthiocyanate
CC1=CC=C(C=C1)C2(CC(N(C3=C2C=C(C=C3)C)C(=O)CSC#N)(C)C)C
InChI=1SC23H26N2OSc1166918(10716)23(5)1422(34)25(21(26)13271524)2011817(2)1219(20)23h612H1314H215H3
MFCD01949614
N#CSCC(=O)N1c2ccc(cc2C(CC1(C)C)(C)c1ccc(cc1)C)C
STK017510
ZINC000002317861
ZINC000002317862

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Available files

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