2-naphthalen-2-yloxy-1-(4-pyrimidin-4-yl-2,6-dipyrrolidin-1-yl-1,4-diazepan-2-yl)ethanone

Systemtic Name: 2-naphthalen-2-yloxy-1-(4-pyrimidin-4-yl-2,6-dipyrrolidin-1-yl-1,4-diazepan-2-yl)ethanone Openeye Name: 2-(2-naphthyloxy)-1-(4-pyrimidin-4-yl-2,6-dipyrrolidin-1-yl-1,4-diazepan-2-yl)ethanone CAS Name: 2-(2-naphthalenyloxy)-1-[4-(4-pyrimidinyl)-2,6-bis(1-pyrrolidinyl)-1,4-diazepan-2-yl]ethanone IUPAC Name: 2-naphthalen-2-yloxy-1-(4-pyrimidin-4-yl-2,6-dipyrrolidin-1-yl-1,4-diazepan-2-yl)ethanone Traditional Name: 2-(2-naphthoxy)-1-[4-(4-pyrimidyl)-2,6-dipyrrolidino-1,4-diazepan-2-yl]ethanone Formula: C29H36N6O2 MolecularWeight: 500.63514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CNC(CN(C2)C3=NC=NC=C3)(C(=O)COC4=CC5=CC=CC=C5C=C4)N6CCCC6

Isomeric SMILES

C1CCN(C1)C2CNC(CN(C2)C3=NC=NC=C3)(C(=O)COC4=CC5=CC=CC=C5C=C4)N6CCCC6

InChI

InChI=1S/C29H36N6O2/c36-27(20-37-26-10-9-23-7-1-2-8-24(23)17-26)29(35-15-5-6-16-35)21-34(28-11-12-30-22-31-28)19-25(18-32-29)33-13-3-4-14-33/h1-2,7-12,17,22,25,32H,3-6,13-16,18-21H2