[4-(1,3-dithiolan-2-yl)phenyl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone CAS Name: [4-(1,3-dithiolan-2-yl)phenyl]-[2-(4-methoxyphenyl)-1-azepanyl]methanone IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone Traditional Name: [4-(1,3-dithiolan-2-yl)phenyl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone Formula: C23H27NO2S2 MolecularWeight: 413.59598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C23H27NO2S2/c1-26-20-12-10-17(11-13-20)21-5-3-2-4-14-24(21)22(25)18-6-8-19(9-7-18)23-27-15-16-28-23/h6-13,21,23H,2-5,14-16H2,1H3