4-azanyl-1-[3-(3-azanylphenoxy)propyl]-5-(3,4-dichlorophenyl)pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[3-(3-azanylphenoxy)propyl]-5-(3,4-dichlorophenyl)pyrimidin-2-one Openeye Name: 4-amino-1-[3-(3-aminophenoxy)propyl]-5-(3,4-dichlorophenyl)pyrimidin-2-one CAS Name: 4-amino-1-[3-(3-aminophenoxy)propyl]-5-(3,4-dichlorophenyl)-2-pyrimidinone IUPAC Name: 4-amino-1-[3-(3-aminophenoxy)propyl]-5-(3,4-dichlorophenyl)pyrimidin-2-one Traditional Name: 4-amino-1-[3-(3-aminophenoxy)propyl]-5-(3,4-dichlorophenyl)pyrimidin-2-one Formula: C19H18Cl2N4O2 MolecularWeight: 405.27782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCN2C=C(C(=NC2=O)N)C3=CC(=C(C=C3)Cl)Cl)N

Isomeric SMILES

C1=CC(=CC(=C1)OCCCN2C=C(C(=NC2=O)N)C3=CC(=C(C=C3)Cl)Cl)N

InChI

InChI=1S/C19H18Cl2N4O2/c20-16-6-5-12(9-17(16)21)15-11-25(19(26)24-18(15)23)7-2-8-27-14-4-1-3-13(22)10-14/h1,3-6,9-11H,2,7-8,22H2,(H2,23,24,26)