N-[(4-fluorophenyl)methyl]-5-(1-methyl-7-oxidanylidene-1,4-diazepan-5-yl)-8-oxidanyl-1,6-naphthyridine-7-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-(1-methyl-7-oxidanylidene-1,4-diazepan-5-yl)-8-oxidanyl-1,6-naphthyridine-7-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(1-methyl-7-oxo-1,4-diazepan-5-yl)-1,6-naphthyridine-7-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(1-methyl-7-oxo-1,4-diazepan-5-yl)-1,6-naphthyridine-7-carboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(1-methyl-7-oxo-1,4-diazepan-5-yl)-1,6-naphthyridine-7-carboxamide Traditional Name: N-(4-fluorobenzyl)-8-hydroxy-5-(7-keto-1-methyl-1,4-diazepan-5-yl)-1,6-naphthyridine-7-carboxamide Formula: C22H22FN5O3 MolecularWeight: 423.440183

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNC(CC1=O)C2=NC(=C(C3=C2C=CC=N3)O)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CN1CCNC(CC1=O)C2=NC(=C(C3=C2C=CC=N3)O)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN5O3/c1-28-10-9-24-16(11-17(28)29)18-15-3-2-8-25-19(15)21(30)20(27-18)22(31)26-12-13-4-6-14(23)7-5-13/h2-8,16,24,30H,9-12H2,1H3,(H,26,31)