N-[3-(azepan-1-yl)propyl]-4-[(4-methylphenyl)sulfanylmethyl]benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-[(4-methylphenyl)sulfanylmethyl]benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-4-(p-tolylsulfanylmethyl)benzamide CAS Name: N-[3-(1-azepanyl)propyl]-4-[[(4-methylphenyl)thio]methyl]benzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-4-[(4-methylphenyl)sulfanylmethyl]benzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-4-[(p-tolylthio)methyl]benzamide Formula: C24H32N2OS MolecularWeight: 396.58868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NCCCN3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NCCCN3CCCCCC3

InChI

InChI=1S/C24H32N2OS/c1-20-7-13-23(14-8-20)28-19-21-9-11-22(12-10-21)24(27)25-15-6-18-26-16-4-2-3-5-17-26/h7-14H,2-6,15-19H2,1H3,(H,25,27)