2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone Formula: C21H22BrNOS MolecularWeight: 416.37448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)N2CCC(=CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)N2CCC(=CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H22BrNOS/c1-15-13-20(16(2)12-19(15)22)25-14-21(24)23-10-8-18(9-11-23)17-6-4-3-5-7-17/h3-8,12-13H,9-11,14H2,1-2H3