2-(4-cyclopropylcarbonylpiperazin-1-yl)-N-[(4-fluorophenyl)methyl]-5-(2-methylpropanoylamino)benzamide

Systemtic Name: 2-(4-cyclopropylcarbonylpiperazin-1-yl)-N-[(4-fluorophenyl)methyl]-5-(2-methylpropanoylamino)benzamide Openeye Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(4-fluorophenyl)methyl]-5-(2-methylpropanoylamino)benzamide CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-N-[(4-fluorophenyl)methyl]-5-[(2-methyl-1-oxopropyl)amino]benzamide IUPAC Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(4-fluorophenyl)methyl]-5-(2-methylpropanoylamino)benzamide Traditional Name: 2-[4-(cyclopropanecarbonyl)piperazino]-N-(4-fluorobenzyl)-5-(isobutyrylamino)benzamide Formula: C26H31FN4O3 MolecularWeight: 466.547743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3CC3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3CC3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C26H31FN4O3/c1-17(2)24(32)29-21-9-10-23(30-11-13-31(14-12-30)26(34)19-5-6-19)22(15-21)25(33)28-16-18-3-7-20(27)8-4-18/h3-4,7-10,15,17,19H,5-6,11-14,16H2,1-2H3,(H,28,33)(H,29,32)