4,5-bis(azanyl)-1-[1,3-bis(phenylmethoxy)propoxymethyl]pyrimidin-2-one

Systemtic Name: 4,5-bis(azanyl)-1-[1,3-bis(phenylmethoxy)propoxymethyl]pyrimidin-2-one Openeye Name: 4,5-diamino-1-(1,3-dibenzyloxypropoxymethyl)pyrimidin-2-one CAS Name: 4,5-diamino-1-[1,3-bis(phenylmethoxy)propoxymethyl]-2-pyrimidinone IUPAC Name: 4,5-diamino-1-[1,3-bis(phenylmethoxy)propoxymethyl]pyrimidin-2-one Traditional Name: 4,5-diamino-1-(1,3-dibenzoxypropoxymethyl)pyrimidin-2-one Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCC(OCC2=CC=CC=C2)OCN3C=C(C(=NC3=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)COCCC(OCC2=CC=CC=C2)OCN3C=C(C(=NC3=O)N)N

InChI

InChI=1S/C22H26N4O4/c23-19-13-26(22(27)25-21(19)24)16-30-20(29-15-18-9-5-2-6-10-18)11-12-28-14-17-7-3-1-4-8-17/h1-10,13,20H,11-12,14-16,23H2,(H2,24,25,27)