7-azanyl-N-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide

Systemtic Name: 7-azanyl-N-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide Openeye Name: 7-amino-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide CAS Name: 7-amino-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide IUPAC Name: 7-amino-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide Traditional Name: 7-amino-N-[(3-keto-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide Formula: C16H14N6O3 MolecularWeight: 338.32076

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)CNC(=O)C3=NC=NC4=C3NC=C4N

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)CNC(=O)C3=NC=NC4=C3NC=C4N

InChI

InChI=1S/C16H14N6O3/c17-9-5-18-14-13(9)20-7-21-15(14)16(24)19-4-8-1-2-11-10(3-8)22-12(23)6-25-11/h1-3,5,7,18H,4,6,17H2,(H,19,24)(H,22,23)