2-azanyl-6,7-bis[(3,4-dichlorophenyl)methyl]-1H-pteridin-4-one

Systemtic Name: 2-azanyl-6,7-bis[(3,4-dichlorophenyl)methyl]-1H-pteridin-4-one Openeye Name: 2-amino-6,7-bis[(3,4-dichlorophenyl)methyl]-1H-pteridin-4-one CAS Name: 2-amino-6,7-bis[(3,4-dichlorophenyl)methyl]-1H-pteridin-4-one IUPAC Name: 2-amino-6,7-bis[(3,4-dichlorophenyl)methyl]-1H-pteridin-4-one Traditional Name: 2-amino-6,7-bis(3,4-dichlorobenzyl)-1H-pteridin-4-one Formula: C20H13Cl4N5O MolecularWeight: 481.16212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC2=NC3=C(NC(=NC3=O)N)N=C2CC4=CC(=C(C=C4)Cl)Cl)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CC2=NC3=C(NC(=NC3=O)N)N=C2CC4=CC(=C(C=C4)Cl)Cl)Cl)Cl

InChI

InChI=1S/C20H13Cl4N5O/c21-11-3-1-9(5-13(11)23)7-15-16(8-10-2-4-12(22)14(24)6-10)27-18-17(26-15)19(30)29-20(25)28-18/h1-6H,7-8H2,(H3,25,27,28,29,30)