2-[[2-[2-(2-hydroxyethylamino)ethanoylamino]pyridin-4-yl]methylsulfanyl]-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide

Systemtic Name: 2-[[2-[2-(2-hydroxyethylamino)ethanoylamino]pyridin-4-yl]methylsulfanyl]-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide Openeye Name: 2-[[2-[[2-(2-hydroxyethylamino)acetyl]amino]-4-pyridyl]methylsulfanyl]-N-(3-isopropylphenyl)pyridine-3-carboxamide CAS Name: 2-[[2-[[2-(2-hydroxyethylamino)-1-oxoethyl]amino]-4-pyridinyl]methylthio]-N-(3-propan-2-ylphenyl)-3-pyridinecarboxamide IUPAC Name: 2-[[2-[[2-(2-hydroxyethylamino)acetyl]amino]pyridin-4-yl]methylsulfanyl]-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide Traditional Name: 2-[[2-[[2-(2-hydroxyethylamino)acetyl]amino]-4-pyridyl]methylthio]-N-m-cumenyl-nicotinamide Formula: C25H29N5O3S MolecularWeight: 479.59446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)NC(=O)CNCCO

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)NC(=O)CNCCO

InChI

InChI=1S/C25H29N5O3S/c1-17(2)19-5-3-6-20(14-19)29-24(33)21-7-4-9-28-25(21)34-16-18-8-10-27-22(13-18)30-23(32)15-26-11-12-31/h3-10,13-14,17,26,31H,11-12,15-16H2,1-2H3,(H,29,33)(H,27,30,32)