Vitas-M small molecule compound
2-[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]-2-oxoethyl thiocyanate
Catalog ID
STK053928
SMILES N#CSCC(=O)N1c2ccccc2C(CC1(C)C)(C)c1ccc(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 C21H21ClN2OS MW 384.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2OS/c1-20(2)13-21(3,15-8-10-16(22)11-9-15)17-6-4-5-7-18(17)24(20)19(25)12-26-14-23/h4-11H,12-13H2,1-3H3InChIKey
YEPPEZCFSNTELI-UHFFFAOYSA-NSynonyms
352659-71-3(2(4(4CHLOROPHENYL)224TRIMETHYL3HQUINOLIN1YL)2OXOETHYL)THIOCYANATE
1(4(4chlorophenyl)224trimethyl34dihydroquinolin1(2H)yl)2thiocyanatoethanone
2(4(4CHLOROPHENYL)224TRIMETHYL34DIHYDRO1(2H)QUINOLINYL)2OXOETHYLTHIOCYANATE
2(4(4CHLOROPHENYL)224TRIMETHYL34DIHYDROQUINOLIN1(2H)YL)2OXOETHYLTHIOCYANATE
352659713
CC1(CC(C2=CC=CC=C2N1C(=O)CSC#N)(C)C3=CC=C(C=C3)Cl)C
InChI=1SC21H21ClN2OSc120(2)1321(31581016(22)11915)17645718(17)24(20)19(25)12261423h411H1213H213H3
MFCD01948929
N#CSCC(=O)N1c2ccccc2C(CC1(C)C)(C)c1ccc(cc1)Cl
STK053928
ZINC000002281752
ZINC000002281753
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