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

Systemtic Name: (5Z)-2-azanyl-5-[[(phenylmethyl)amino]methylidene]-1H-pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: (5Z)-2-amino-5-[(benzylamino)methylene]-1H-pyrrolo[2,3-d]pyrimidin-4-one CAS Name: (5Z)-2-amino-5-[[(phenylmethyl)amino]methylidene]-1H-pyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: (5Z)-2-amino-5-[(benzylamino)methylidene]-1H-pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: (5Z)-2-amino-5-[(benzylamino)methylene]-1H-pyrrolo[2,3-d]pyrimidin-4-one Formula: C14H13N5O MolecularWeight: 267.28592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC=C2C=NC3=C2C(=O)N=C(N3)N

Isomeric SMILES

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

InChI

InChI=1S/C14H13N5O/c15-14-18-12-11(13(20)19-14)10(8-17-12)7-16-6-9-4-2-1-3-5-9/h1-5,7-8,16H,6H2,(H3,15,18,19,20)/b10-7+