4-(azepan-1-ylmethyl)-N-[2-(4-methylphenyl)sulfanylethyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[2-(4-methylphenyl)sulfanylethyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[2-(p-tolylsulfanyl)ethyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[2-[(4-methylphenyl)thio]ethyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[2-(4-methylphenyl)sulfanylethyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-[2-(p-tolylthio)ethyl]benzamide Formula: C23H30N2OS MolecularWeight: 382.5621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)CN3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)CN3CCCCCC3

InChI

InChI=1S/C23H30N2OS/c1-19-6-12-22(13-7-19)27-17-14-24-23(26)21-10-8-20(9-11-21)18-25-15-4-2-3-5-16-25/h6-13H,2-5,14-18H2,1H3,(H,24,26)