N-[2-oxidanyl-3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propyl]-2-[(4-propan-2-ylphenyl)amino]pyridine-3-carboxamide

Systemtic Name: N-[2-oxidanyl-3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propyl]-2-[(4-propan-2-ylphenyl)amino]pyridine-3-carboxamide Openeye Name: N-[2-hydroxy-3-[4-(2-isopropoxyphenyl)piperazin-1-yl]propyl]-2-(4-isopropylanilino)pyridine-3-carboxamide CAS Name: N-[2-hydroxy-3-[4-(2-propan-2-yloxyphenyl)-1-piperazinyl]propyl]-2-(4-propan-2-ylanilino)-3-pyridinecarboxamide IUPAC Name: N-[2-hydroxy-3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propyl]-2-(4-propan-2-ylanilino)pyridine-3-carboxamide Traditional Name: 2-cumidino-N-[2-hydroxy-3-[4-(2-isopropoxyphenyl)piperazino]propyl]nicotinamide Formula: C31H41N5O3 MolecularWeight: 531.68894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)NCC(CN3CCN(CC3)C4=CC=CC=C4OC(C)C)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)NCC(CN3CCN(CC3)C4=CC=CC=C4OC(C)C)O

InChI

InChI=1S/C31H41N5O3/c1-22(2)24-11-13-25(14-12-24)34-30-27(8-7-15-32-30)31(38)33-20-26(37)21-35-16-18-36(19-17-35)28-9-5-6-10-29(28)39-23(3)4/h5-15,22-23,26,37H,16-21H2,1-4H3,(H,32,34)(H,33,38)