3-(pyridin-3-ylmethylideneamino)-9H-pyrimido[4,5-b]indol-2-one

Systemtic Name: 3-(pyridin-3-ylmethylideneamino)-9H-pyrimido[4,5-b]indol-2-one Openeye Name: 3-(3-pyridylmethyleneamino)-9H-pyrimido[4,5-b]indol-2-one CAS Name: 3-(3-pyridinylmethylideneamino)-9H-pyrimido[4,5-b]indol-2-one IUPAC Name: 3-(pyridin-3-ylmethylideneamino)-9H-pyrimido[4,5-b]indol-2-one Traditional Name: 3-(3-pyridylmethyleneamino)-9H-pyrimid[4,5-b]indol-2-one Formula: C16H11N5O MolecularWeight: 289.29144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CN(C(=O)N=C3N2)N=CC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C3=CN(C(=O)N=C3N2)N=CC4=CN=CC=C4

InChI

InChI=1S/C16H11N5O/c22-16-20-15-13(12-5-1-2-6-14(12)19-15)10-21(16)18-9-11-4-3-7-17-8-11/h1-10H,(H,19,20,22)