N-[2-(azepan-1-ylcarbonyl)phenyl]-2-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-[(4-methoxyphenyl)thio]propionamide Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2)SC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2)SC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H28N2O3S/c1-17(29-19-13-11-18(28-2)12-14-19)22(26)24-21-10-6-5-9-20(21)23(27)25-15-7-3-4-8-16-25/h5-6,9-14,17H,3-4,7-8,15-16H2,1-2H3,(H,24,26)