2-(4-azido-3-iodanyl-phenyl)-N-[5-[2-[(4-methoxyphenyl)methyl-pyridin-2-yl-amino]ethyl-methyl-amino]pentyl]ethanamide

Systemtic Name: 2-(4-azido-3-iodanyl-phenyl)-N-[5-[2-[(4-methoxyphenyl)methyl-pyridin-2-yl-amino]ethyl-methyl-amino]pentyl]ethanamide Openeye Name: 2-(4-azido-3-iodanyl-phenyl)-N-[5-[2-[(4-methoxyphenyl)methyl-(2-pyridyl)amino]ethyl-methyl-amino]pentyl]acetamide CAS Name: 2-(4-azido-3-iodanylphenyl)-N-[5-[2-[(4-methoxyphenyl)methyl-(2-pyridinyl)amino]ethyl-methylamino]pentyl]acetamide IUPAC Name: 2-(4-azido-3-iodanylphenyl)-N-[5-[2-[(4-methoxyphenyl)methyl-pyridin-2-ylamino]ethyl-methylamino]pentyl]acetamide Traditional Name: 2-(4-azido-3-iodanyl-phenyl)-N-[5-[methyl-[2-[p-anisyl(2-pyridyl)amino]ethyl]amino]pentyl]acetamide Formula: C29H36IN7O2 MolecularWeight: 639.546464

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCCNC(=O)CC1=CC(=C(C=C1)N=[N+]=[N-])I)CCN(CC2=CC=C(C=C2)OC)C3=CC=CC=N3

Isomeric SMILES

CN(CCCCCNC(=O)CC1=CC(=C(C=C1)N=[N+]=[N-])[125I])CCN(CC2=CC=C(C=C2)OC)C3=CC=CC=N3

InChI

InChI=1S/C29H36IN7O2/c1-36(17-7-3-5-16-33-29(38)21-24-11-14-27(34-35-31)26(30)20-24)18-19-37(28-8-4-6-15-32-28)22-23-9-12-25(39-2)13-10-23/h4,6,8-15,20H,3,5,7,16-19,21-22H2,1-2H3,(H,33,38)/i30-2