1-(azepan-1-yl)-2-phenanthridin-6-ylsulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-phenanthridin-6-ylsulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-phenanthridin-6-ylsulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-(6-phenanthridinylthio)ethanone IUPAC Name: 1-(azepan-1-yl)-2-phenanthridin-6-ylsulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-(phenanthridin-6-ylthio)ethanone Formula: C21H22N2OS MolecularWeight: 350.47718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NC3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NC3=CC=CC=C3C4=CC=CC=C42

InChI

InChI=1S/C21H22N2OS/c24-20(23-13-7-1-2-8-14-23)15-25-21-18-11-4-3-9-16(18)17-10-5-6-12-19(17)22-21/h3-6,9-12H,1-2,7-8,13-15H2