N-[1-[(6-azanyl-2,2,4-trimethyl-hexyl)amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-5-iodanyl-pyridine-3-carboxamide

Systemtic Name: N-[1-[(6-azanyl-2,2,4-trimethyl-hexyl)amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-5-iodanyl-pyridine-3-carboxamide Openeye Name: N-[2-[(6-amino-2,2,4-trimethyl-hexyl)amino]-1-(2-naphthylmethyl)-2-oxo-ethyl]-5-iodanyl-pyridine-3-carboxamide CAS Name: N-[1-[(6-amino-2,2,4-trimethylhexyl)amino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-5-iodanyl-3-pyridinecarboxamide IUPAC Name: N-[1-[(6-amino-2,2,4-trimethylhexyl)amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-5-iodanylpyridine-3-carboxamide Traditional Name: N-[2-[(6-amino-2,2,4-trimethyl-hexyl)amino]-2-keto-1-(2-naphthylmethyl)ethyl]-5-iodanyl-nicotinamide Formula: C28H35IN4O2 MolecularWeight: 590.509224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCN)CC(C)(C)CNC(=O)C(CC1=CC2=CC=CC=C2C=C1)NC(=O)C3=CC(=CN=C3)I

Isomeric SMILES

CC(CCN)CC(C)(C)CNC(=O)C(CC1=CC2=CC=CC=C2C=C1)NC(=O)C3=CC(=CN=C3)[131I]

InChI

InChI=1S/C28H35IN4O2/c1-19(10-11-30)15-28(2,3)18-32-27(35)25(33-26(34)23-14-24(29)17-31-16-23)13-20-8-9-21-6-4-5-7-22(21)12-20/h4-9,12,14,16-17,19,25H,10-11,13,15,18,30H2,1-3H3,(H,32,35)(H,33,34)/i29+4