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

Systemtic Name: 2-azanyl-5-[[phenyl(pyrrolidin-3-yl)amino]methyl]pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2-amino-5-[(N-pyrrolidin-3-ylanilino)methyl]pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2-amino-5-[[N-(3-pyrrolidinyl)anilino]methyl]-4-pyrrolo[2,3-d]pyrimidinone IUPAC Name: 2-amino-5-[(N-pyrrolidin-3-ylanilino)methyl]pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2-amino-5-[(N-pyrrolidin-3-ylanilino)methyl]pyrrolo[2,3-d]pyrimidin-4-one Formula: C17H18N6O MolecularWeight: 322.36442

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1N(CC2=C3C(=NC(=NC3=O)N)N=C2)C4=CC=CC=C4

Isomeric SMILES

C1CNCC1N(CC2=C3C(=NC(=NC3=O)N)N=C2)C4=CC=CC=C4

InChI

InChI=1S/C17H18N6O/c18-17-21-15-14(16(24)22-17)11(8-20-15)10-23(13-6-7-19-9-13)12-4-2-1-3-5-12/h1-5,8,13,19H,6-7,9-10H2,(H2,18,22,24)