N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-(2-methylpropanoylamino)pentanoyl]piperazine-1-carboxamide

Systemtic Name: N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-(2-methylpropanoylamino)pentanoyl]piperazine-1-carboxamide Openeye Name: N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-(2-methylpropanoylamino)pentanoyl]piperazine-1-carboxamide CAS Name: N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-[(2-methyl-1-oxopropyl)amino]-1-oxopentyl]-1-piperazinecarboxamide IUPAC Name: N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-(2-methylpropanoylamino)pentanoyl]piperazine-1-carboxamide Traditional Name: N-(3-chlorophenyl)-4-[2-(isobutyrylamino)-3-methyl-pentanoyl]-2-methyl-piperazine-1-carboxamide Formula: C22H33ClN4O3 MolecularWeight: 436.97542

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(C(C1)C)C(=O)NC2=CC(=CC=C2)Cl)NC(=O)C(C)C

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(C(C1)C)C(=O)NC2=CC(=CC=C2)Cl)NC(=O)C(C)C

InChI

InChI=1S/C22H33ClN4O3/c1-6-15(4)19(25-20(28)14(2)3)21(29)26-10-11-27(16(5)13-26)22(30)24-18-9-7-8-17(23)12-18/h7-9,12,14-16,19H,6,10-11,13H2,1-5H3,(H,24,30)(H,25,28)