9-chloranyl-3-(3-imidazol-1-ylpropyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 9-chloranyl-3-(3-imidazol-1-ylpropyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 9-chloro-3-(3-imidazol-1-ylpropyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 9-chloro-3-[3-(1-imidazolyl)propyl]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 9-chloro-3-(3-imidazol-1-ylpropyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 9-chloro-3-(3-imidazol-1-ylpropyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C16H14ClN5O MolecularWeight: 327.76826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)C3=C(N2)C(=O)N(C=N3)CCCN4C=CN=C4

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)C3=C(N2)C(=O)N(C=N3)CCCN4C=CN=C4

InChI

InChI=1S/C16H14ClN5O/c17-11-3-1-4-12-13(11)14-15(20-12)16(23)22(10-19-14)7-2-6-21-8-5-18-9-21/h1,3-5,8-10,20H,2,6-7H2