(5Z)-2-azanyl-5-[[(4-chlorophenyl)methylamino]methylidene]-1H-pyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: (5Z)-2-azanyl-5-[[(4-chlorophenyl)methylamino]methylidene]-1H-pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: (5Z)-2-amino-5-[[(4-chlorophenyl)methylamino]methylene]-1H-pyrrolo[2,3-d]pyrimidin-4-one CAS Name: (5Z)-2-amino-5-[[(4-chlorophenyl)methylamino]methylidene]-1H-pyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: (5Z)-2-amino-5-[[(4-chlorophenyl)methylamino]methylidene]-1H-pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: (5Z)-2-amino-5-[[(4-chlorobenzyl)amino]methylene]-1H-pyrrolo[2,3-d]pyrimidin-4-one Formula: C14H12ClN5O MolecularWeight: 301.73098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC=C2C=NC3=C2C(=O)N=C(N3)N)Cl

Isomeric SMILES

C1=CC(=CC=C1CN/C=C/2\C=NC3=C2C(=O)N=C(N3)N)Cl

InChI

InChI=1S/C14H12ClN5O/c15-10-3-1-8(2-4-10)5-17-6-9-7-18-12-11(9)13(21)20-14(16)19-12/h1-4,6-7,17H,5H2,(H3,16,19,20,21)/b9-6+