2-(4-bromophenyl)sulfanyl-N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]ethanamide

Systemtic Name: 2-(4-bromophenyl)sulfanyl-N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]ethanamide Openeye Name: 2-(4-bromophenyl)sulfanyl-N-[1-(m-tolylmethyl)-4-piperidyl]acetamide CAS Name: 2-[(4-bromophenyl)thio]-N-[1-[(3-methylphenyl)methyl]-4-piperidinyl]acetamide IUPAC Name: 2-(4-bromophenyl)sulfanyl-N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]acetamide Traditional Name: 2-[(4-bromophenyl)thio]-N-[1-(3-methylbenzyl)-4-piperidyl]acetamide Formula: C21H25BrN2OS MolecularWeight: 433.405

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC(CC2)NC(=O)CSC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC(CC2)NC(=O)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrN2OS/c1-16-3-2-4-17(13-16)14-24-11-9-19(10-12-24)23-21(25)15-26-20-7-5-18(22)6-8-20/h2-8,13,19H,9-12,14-15H2,1H3,(H,23,25)