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

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[2-[(2-chlorophenyl)methylthio]ethyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-[2-[(2-chlorobenzyl)thio]ethyl]benzamide Formula: C23H29ClN2OS MolecularWeight: 417.00716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3Cl

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3Cl

InChI

InChI=1S/C23H29ClN2OS/c24-22-8-4-3-7-21(22)18-28-16-13-25-23(27)20-11-9-19(10-12-20)17-26-14-5-1-2-6-15-26/h3-4,7-12H,1-2,5-6,13-18H2,(H,25,27)