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

Systemtic Name: N-(4-imidazol-1-ylbutyl)-4-methoxy-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxamide Openeye Name: N-(4-imidazol-1-ylbutyl)-4-methoxy-11-oxo-pyrido[2,1-b]quinazoline-8-carboxamide CAS Name: N-[4-(1-imidazolyl)butyl]-4-methoxy-11-oxo-8-pyrido[2,1-b]quinazolinecarboxamide IUPAC Name: N-(4-imidazol-1-ylbutyl)-4-methoxy-11-oxopyrido[2,1-b]quinazoline-8-carboxamide Traditional Name: N-(4-imidazol-1-ylbutyl)-11-keto-4-methoxy-pyrido[2,1-b]quinazoline-8-carboxamide Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N=C3C=CC(=CN3C2=O)C(=O)NCCCCN4C=CN=C4

Isomeric SMILES

COC1=CC=CC2=C1N=C3C=CC(=CN3C2=O)C(=O)NCCCCN4C=CN=C4

InChI

InChI=1S/C21H21N5O3/c1-29-17-6-4-5-16-19(17)24-18-8-7-15(13-26(18)21(16)28)20(27)23-9-2-3-11-25-12-10-22-14-25/h4-8,10,12-14H,2-3,9,11H2,1H3,(H,23,27)