N-[2-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]cyclohexanecarboxamide

Systemtic Name: N-[2-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]cyclohexanecarboxamide Openeye Name: N-[2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]cyclohexanecarboxamide CAS Name: N-[2-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]cyclohexanecarboxamide Traditional Name: N-[2-[4-(4-tert-butylbenzoyl)piperazino]-5-(piperazine-1-carbonyl)phenyl]cyclohexanecarboxamide Formula: C33H45N5O3 MolecularWeight: 559.7421

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)C5CCCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)C5CCCCC5

InChI

InChI=1S/C33H45N5O3/c1-33(2,3)27-12-9-25(10-13-27)31(40)38-21-19-36(20-22-38)29-14-11-26(32(41)37-17-15-34-16-18-37)23-28(29)35-30(39)24-7-5-4-6-8-24/h9-14,23-24,34H,4-8,15-22H2,1-3H3,(H,35,39)