4-[4-(pyridin-4-ylamino)phenyl]carbonyl-N-(2,4,6-trimethylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[4-(pyridin-4-ylamino)phenyl]carbonyl-N-(2,4,6-trimethylphenyl)piperazine-1-carboxamide Openeye Name: 4-[4-(4-pyridylamino)benzoyl]-N-(2,4,6-trimethylphenyl)piperazine-1-carboxamide CAS Name: 4-[oxo-[4-(pyridin-4-ylamino)phenyl]methyl]-N-(2,4,6-trimethylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[4-(pyridin-4-ylamino)benzoyl]-N-(2,4,6-trimethylphenyl)piperazine-1-carboxamide Traditional Name: N-mesityl-4-[4-(4-pyridylamino)benzoyl]piperazine-1-carboxamide Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC4=CC=NC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC4=CC=NC=C4)C

InChI

InChI=1S/C26H29N5O2/c1-18-16-19(2)24(20(3)17-18)29-26(33)31-14-12-30(13-15-31)25(32)21-4-6-22(7-5-21)28-23-8-10-27-11-9-23/h4-11,16-17H,12-15H2,1-3H3,(H,27,28)(H,29,33)