2-[5-azanyl-3-oxidanylidene-1-(pyridin-3-ylmethyl)-2H-pyrrol-4-yl]-1H-quinazolin-4-one

Systemtic Name: 2-[5-azanyl-3-oxidanylidene-1-(pyridin-3-ylmethyl)-2H-pyrrol-4-yl]-1H-quinazolin-4-one Openeye Name: 2-[5-amino-3-oxo-1-(3-pyridylmethyl)-2H-pyrrol-4-yl]-1H-quinazolin-4-one CAS Name: 2-[5-amino-3-oxo-1-(3-pyridinylmethyl)-2H-pyrrol-4-yl]-1H-quinazolin-4-one IUPAC Name: 2-[5-amino-3-oxo-1-(pyridin-3-ylmethyl)-2H-pyrrol-4-yl]-1H-quinazolin-4-one Traditional Name: 2-[2-amino-4-keto-1-(3-pyridylmethyl)-2-pyrrolin-3-yl]-1H-quinazolin-4-one Formula: C18H15N5O2 MolecularWeight: 333.344

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1CC2=CN=CC=C2)N)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1C(=O)C(=C(N1CC2=CN=CC=C2)N)C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C18H15N5O2/c19-16-15(14(24)10-23(16)9-11-4-3-7-20-8-11)17-21-13-6-2-1-5-12(13)18(25)22-17/h1-8H,9-10,19H2,(H,21,22,25)