4-[2,6-bis(azanyl)pyrimidin-4-yl]-3-naphthalen-1-yloxy-1-propyl-piperazin-2-ol

Systemtic Name: 4-[2,6-bis(azanyl)pyrimidin-4-yl]-3-naphthalen-1-yloxy-1-propyl-piperazin-2-ol Openeye Name: 4-(2,6-diaminopyrimidin-4-yl)-3-(1-naphthyloxy)-1-propyl-piperazin-2-ol CAS Name: 4-(2,6-diamino-4-pyrimidinyl)-3-(1-naphthalenyloxy)-1-propyl-2-piperazinol IUPAC Name: 4-(2,6-diaminopyrimidin-4-yl)-3-naphthalen-1-yloxy-1-propylpiperazin-2-ol Traditional Name: 4-(2,6-diaminopyrimidin-4-yl)-3-(1-naphthoxy)-1-propyl-piperazin-2-ol Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(C(C1O)OC2=CC=CC3=CC=CC=C32)C4=CC(=NC(=N4)N)N

Isomeric SMILES

CCCN1CCN(C(C1O)OC2=CC=CC3=CC=CC=C32)C4=CC(=NC(=N4)N)N

InChI

InChI=1S/C21H26N6O2/c1-2-10-26-11-12-27(18-13-17(22)24-21(23)25-18)20(19(26)28)29-16-9-5-7-14-6-3-4-8-15(14)16/h3-9,13,19-20,28H,2,10-12H2,1H3,(H4,22,23,24,25)