4-(azepan-1-ylmethyl)-N-[2-(phenylmethylsulfanyl)ethyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[2-(phenylmethylsulfanyl)ethyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-(2-benzylsulfanylethyl)benzamide CAS Name: 4-(1-azepanylmethyl)-N-[2-(phenylmethylthio)ethyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-(2-benzylsulfanylethyl)benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-[2-(benzylthio)ethyl]benzamide Formula: C23H30N2OS MolecularWeight: 382.5621

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C23H30N2OS/c26-23(24-14-17-27-19-21-8-4-3-5-9-21)22-12-10-20(11-13-22)18-25-15-6-1-2-7-16-25/h3-5,8-13H,1-2,6-7,14-19H2,(H,24,26)