N-(4,7-phenanthrolin-5-yl)morpholine-4-carbothioamide

Systemtic Name: N-(4,7-phenanthrolin-5-yl)morpholine-4-carbothioamide Openeye Name: N-(4,7-phenanthrolin-5-yl)morpholine-4-carbothioamide CAS Name: N-(4,7-phenanthrolin-5-yl)-4-morpholinecarbothioamide IUPAC Name: N-(4,7-phenanthrolin-5-yl)morpholine-4-carbothioamide Traditional Name: N-(4,7-phenanthrolin-5-yl)morpholine-4-carbothioamide Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)NC2=C3C(=C4C=CC=NC4=C2)C=CC=N3

Isomeric SMILES

C1COCCN1C(=S)NC2=C3C(=C4C=CC=NC4=C2)C=CC=N3

InChI

InChI=1S/C17H16N4OS/c23-17(21-7-9-22-10-8-21)20-15-11-14-12(3-1-5-18-14)13-4-2-6-19-16(13)15/h1-6,11H,7-10H2,(H,20,23)