2-azanyl-5-[[(4-phenylazanylphenyl)amino]methyl]pyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-5-[[(4-phenylazanylphenyl)amino]methyl]pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2-amino-5-[(4-anilinoanilino)methyl]pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2-amino-5-[(4-anilinoanilino)methyl]-4-pyrrolo[2,3-d]pyrimidinone IUPAC Name: 2-amino-5-[(4-anilinoanilino)methyl]pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2-amino-5-[(4-anilinoanilino)methyl]pyrrolo[2,3-d]pyrimidin-4-one Formula: C19H16N6O MolecularWeight: 344.36994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NCC3=C4C(=NC(=NC4=O)N)N=C3

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NCC3=C4C(=NC(=NC4=O)N)N=C3

InChI

InChI=1S/C19H16N6O/c20-19-24-17-16(18(26)25-19)12(11-22-17)10-21-13-6-8-15(9-7-13)23-14-4-2-1-3-5-14/h1-9,11,21,23H,10H2,(H2,20,25,26)