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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[4-[(4-dimethylaminophenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[4-[(4-dimethylaminophenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[4-[(4-dimethylaminophenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[4-[(4-dimethylaminophenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-[4-(dimethylamino)benzyl]piperazino]acetamide Formula: C22H29BrN4O MolecularWeight: 445.39586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H29BrN4O/c1-17-14-19(23)6-9-21(17)24-22(28)16-27-12-10-26(11-13-27)15-18-4-7-20(8-5-18)25(2)3/h4-9,14H,10-13,15-16H2,1-3H3,(H,24,28)