5-bromanyl-N-(4-methylpiperidin-1-yl)carbothioyl-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-(4-methylpiperidin-1-yl)carbothioyl-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-(4-methylpiperidine-1-carbothioyl)-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-(4-methylpiperidine-1-carbothioyl)-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-(4-methylpiperidine-1-carbothioyl)-2-phenethyloxy-benzamide Formula: C22H25BrN2O2S MolecularWeight: 461.4151

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

Isomeric SMILES

CC1CCN(CC1)C(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C22H25BrN2O2S/c1-16-9-12-25(13-10-16)22(28)24-21(26)19-15-18(23)7-8-20(19)27-14-11-17-5-3-2-4-6-17/h2-8,15-16H,9-14H2,1H3,(H,24,26,28)