N-(3-azanyl-4-methyl-phenyl)-4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-(3-azanyl-4-methyl-phenyl)-4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)benzamide Openeye Name: N-(3-amino-4-methyl-phenyl)-4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)benzamide CAS Name: N-(3-amino-4-methylphenyl)-4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-(3-amino-4-methylphenyl)-4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)benzamide Traditional Name: N-(3-amino-4-methyl-phenyl)-4-[(4-methylpiperazino)methyl]-3-(trifluoromethyl)benzamide Formula: C21H25F3N4O MolecularWeight: 406.44461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)CN3CCN(CC3)C)C(F)(F)F)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)CN3CCN(CC3)C)C(F)(F)F)N

InChI

InChI=1S/C21H25F3N4O/c1-14-3-6-17(12-19(14)25)26-20(29)15-4-5-16(18(11-15)21(22,23)24)13-28-9-7-27(2)8-10-28/h3-6,11-12H,7-10,13,25H2,1-2H3,(H,26,29)