2-azanyl-3-(3-oxidanylpropyl)-6,7-diphenyl-pteridin-4-one

Systemtic Name: 2-azanyl-3-(3-oxidanylpropyl)-6,7-diphenyl-pteridin-4-one Openeye Name: 2-amino-3-(3-hydroxypropyl)-6,7-diphenyl-pteridin-4-one CAS Name: 2-amino-3-(3-hydroxypropyl)-6,7-diphenyl-4-pteridinone IUPAC Name: 2-amino-3-(3-hydroxypropyl)-6,7-diphenylpteridin-4-one Traditional Name: 2-amino-3-(3-hydroxypropyl)-6,7-diphenyl-pteridin-4-one Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(N=C2C4=CC=CC=C4)N=C(N(C3=O)CCCO)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(N=C2C4=CC=CC=C4)N=C(N(C3=O)CCCO)N

InChI

InChI=1S/C21H19N5O2/c22-21-25-19-18(20(28)26(21)12-7-13-27)23-16(14-8-3-1-4-9-14)17(24-19)15-10-5-2-6-11-15/h1-6,8-11,27H,7,12-13H2,(H2,22,24,25)