N-[3-(5-methylsulfanyl-2-phenylmethoxy-phenyl)propyl]-N-propyl-benzamide

Systemtic Name: N-[3-(5-methylsulfanyl-2-phenylmethoxy-phenyl)propyl]-N-propyl-benzamide Openeye Name: N-[3-(2-benzyloxy-5-methylsulfanyl-phenyl)propyl]-N-propyl-benzamide CAS Name: N-[3-[5-(methylthio)-2-phenylmethoxyphenyl]propyl]-N-propylbenzamide IUPAC Name: N-[3-(5-methylsulfanyl-2-phenylmethoxyphenyl)propyl]-N-propylbenzamide Traditional Name: N-[3-[2-benzoxy-5-(methylthio)phenyl]propyl]-N-propyl-benzamide Formula: C27H31NO2S MolecularWeight: 433.60554

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC1=C(C=CC(=C1)SC)OCC2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCN(CCCC1=C(C=CC(=C1)SC)OCC2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H31NO2S/c1-3-18-28(27(29)23-13-8-5-9-14-23)19-10-15-24-20-25(31-2)16-17-26(24)30-21-22-11-6-4-7-12-22/h4-9,11-14,16-17,20H,3,10,15,18-19,21H2,1-2H3