N-(4-chlorophenyl)-4-[2-(diethylcarbamoyl)-4-(2-methylpropanoylamino)phenyl]piperazine-1-carboxamide

Systemtic Name: N-(4-chlorophenyl)-4-[2-(diethylcarbamoyl)-4-(2-methylpropanoylamino)phenyl]piperazine-1-carboxamide Openeye Name: N-(4-chlorophenyl)-4-[2-(diethylcarbamoyl)-4-(2-methylpropanoylamino)phenyl]piperazine-1-carboxamide CAS Name: N-(4-chlorophenyl)-4-[2-[diethylamino(oxo)methyl]-4-[(2-methyl-1-oxopropyl)amino]phenyl]-1-piperazinecarboxamide IUPAC Name: N-(4-chlorophenyl)-4-[2-(diethylcarbamoyl)-4-(2-methylpropanoylamino)phenyl]piperazine-1-carboxamide Traditional Name: N-(4-chlorophenyl)-4-[2-(diethylcarbamoyl)-4-(isobutyrylamino)phenyl]piperazine-1-carboxamide Formula: C26H34ClN5O3 MolecularWeight: 500.03286

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=CC(=C1)NC(=O)C(C)C)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=CC(=C1)NC(=O)C(C)C)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H34ClN5O3/c1-5-30(6-2)25(34)22-17-21(28-24(33)18(3)4)11-12-23(22)31-13-15-32(16-14-31)26(35)29-20-9-7-19(27)8-10-20/h7-12,17-18H,5-6,13-16H2,1-4H3,(H,28,33)(H,29,35)