4-tert-butyl-N-[2-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]benzamide Openeye Name: 4-tert-butyl-N-[2-[4-(3-chlorobenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]benzamide CAS Name: 4-tert-butyl-N-[2-[4-[(3-chlorophenyl)-oxomethyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[4-(3-chlorobenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[2-[4-(3-chlorobenzoyl)piperazino]-5-(piperazine-1-carbonyl)phenyl]benzamide Formula: C33H38ClN5O3 MolecularWeight: 588.13952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCN(CC4)C(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCN(CC4)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C33H38ClN5O3/c1-33(2,3)26-10-7-23(8-11-26)30(40)36-28-22-25(32(42)38-15-13-35-14-16-38)9-12-29(28)37-17-19-39(20-18-37)31(41)24-5-4-6-27(34)21-24/h4-12,21-22,35H,13-20H2,1-3H3,(H,36,40)