4-chloranyl-N-(4-imidazol-1-ylbutyl)-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxamide

Systemtic Name: 4-chloranyl-N-(4-imidazol-1-ylbutyl)-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxamide Openeye Name: 4-chloro-N-(4-imidazol-1-ylbutyl)-11-oxo-pyrido[2,1-b]quinazoline-8-carboxamide CAS Name: 4-chloro-N-[4-(1-imidazolyl)butyl]-11-oxo-8-pyrido[2,1-b]quinazolinecarboxamide IUPAC Name: 4-chloro-N-(4-imidazol-1-ylbutyl)-11-oxopyrido[2,1-b]quinazoline-8-carboxamide Traditional Name: 4-chloro-N-(4-imidazol-1-ylbutyl)-11-keto-pyrido[2,1-b]quinazoline-8-carboxamide Formula: C20H18ClN5O2 MolecularWeight: 395.84222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)N=C3C=CC(=CN3C2=O)C(=O)NCCCCN4C=CN=C4

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)N=C3C=CC(=CN3C2=O)C(=O)NCCCCN4C=CN=C4

InChI

InChI=1S/C20H18ClN5O2/c21-16-5-3-4-15-18(16)24-17-7-6-14(12-26(17)20(15)28)19(27)23-8-1-2-10-25-11-9-22-13-25/h3-7,9,11-13H,1-2,8,10H2,(H,23,27)