2-(4-bromanyl-2-methyl-phenyl)sulfanyl-1-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2-methyl-phenyl)sulfanyl-1-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone Openeye Name: 2-(4-bromo-2-methyl-phenyl)sulfanyl-1-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone CAS Name: 2-[(4-bromo-2-methylphenyl)thio]-1-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone IUPAC Name: 2-(4-bromo-2-methylphenyl)sulfanyl-1-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]-1-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone Formula: C17H18BrNOS2 MolecularWeight: 396.36492

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(CCN1C(=O)CSC3=C(C=C(C=C3)Br)C)SC=C2

Isomeric SMILES

C[C@H]1C2=C(CCN1C(=O)CSC3=C(C=C(C=C3)Br)C)SC=C2

InChI

InChI=1S/C17H18BrNOS2/c1-11-9-13(18)3-4-15(11)22-10-17(20)19-7-5-16-14(12(19)2)6-8-21-16/h3-4,6,8-9,12H,5,7,10H2,1-2H3/t12-/m0/s1