4-azanyl-1-[2-[(2,5-dimethylphenyl)methoxy]ethoxymethyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[2-[(2,5-dimethylphenyl)methoxy]ethoxymethyl]pyrimidin-2-one Openeye Name: 4-amino-1-[2-[(2,5-dimethylphenyl)methoxy]ethoxymethyl]pyrimidin-2-one CAS Name: 4-amino-1-[2-[(2,5-dimethylphenyl)methoxy]ethoxymethyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[2-[(2,5-dimethylphenyl)methoxy]ethoxymethyl]pyrimidin-2-one Traditional Name: 4-amino-1-[2-(2,5-dimethylbenzyl)oxyethoxymethyl]pyrimidin-2-one Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COCCOCN2C=CC(=NC2=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)COCCOCN2C=CC(=NC2=O)N

InChI

InChI=1S/C16H21N3O3/c1-12-3-4-13(2)14(9-12)10-21-7-8-22-11-19-6-5-15(17)18-16(19)20/h3-6,9H,7-8,10-11H2,1-2H3,(H2,17,18,20)