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

Systemtic Name: N-[(4-fluorophenyl)methyl]-8-oxidanyl-5-(5-oxidanylidene-1,4-thiazepan-7-yl)-1,6-naphthyridine-7-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(5-oxo-1,4-thiazepan-7-yl)-1,6-naphthyridine-7-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(5-oxo-1,4-thiazepan-7-yl)-1,6-naphthyridine-7-carboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(5-oxo-1,4-thiazepan-7-yl)-1,6-naphthyridine-7-carboxamide Traditional Name: N-(4-fluorobenzyl)-8-hydroxy-5-(5-keto-1,4-thiazepan-7-yl)-1,6-naphthyridine-7-carboxamide Formula: C21H19FN4O3S MolecularWeight: 426.463963

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(CC(=O)N1)C2=NC(=C(C3=C2C=CC=N3)O)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CSC(CC(=O)N1)C2=NC(=C(C3=C2C=CC=N3)O)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H19FN4O3S/c22-13-5-3-12(4-6-13)11-25-21(29)19-20(28)18-14(2-1-7-24-18)17(26-19)15-10-16(27)23-8-9-30-15/h1-7,15,28H,8-11H2,(H,23,27)(H,25,29)