N-(4-bromanyl-3-methyl-phenyl)-2-[4-(2-cyanophenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[4-(2-cyanophenyl)piperazin-1-yl]ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[4-(2-cyanophenyl)piperazin-1-yl]acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[4-(2-cyanophenyl)-1-piperazinyl]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[4-(2-cyanophenyl)piperazin-1-yl]acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[4-(2-cyanophenyl)piperazino]acetamide Formula: C20H21BrN4O MolecularWeight: 413.31094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CN2CCN(CC2)C3=CC=CC=C3C#N)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CN2CCN(CC2)C3=CC=CC=C3C#N)Br

InChI

InChI=1S/C20H21BrN4O/c1-15-12-17(6-7-18(15)21)23-20(26)14-24-8-10-25(11-9-24)19-5-3-2-4-16(19)13-22/h2-7,12H,8-11,14H2,1H3,(H,23,26)