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

Systemtic Name: N-(2-hydroxyethyl)-N-[3-(5-methylsulfanyl-2-phenylmethoxy-phenyl)propyl]benzamide Openeye Name: N-[3-(2-benzyloxy-5-methylsulfanyl-phenyl)propyl]-N-(2-hydroxyethyl)benzamide CAS Name: N-(2-hydroxyethyl)-N-[3-[5-(methylthio)-2-phenylmethoxyphenyl]propyl]benzamide IUPAC Name: N-(2-hydroxyethyl)-N-[3-(5-methylsulfanyl-2-phenylmethoxyphenyl)propyl]benzamide Traditional Name: N-[3-[2-benzoxy-5-(methylthio)phenyl]propyl]-N-(2-hydroxyethyl)benzamide Formula: C26H29NO3S MolecularWeight: 435.57836

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCN(CCO)C(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCN(CCO)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H29NO3S/c1-31-24-14-15-25(30-20-21-9-4-2-5-10-21)23(19-24)13-8-16-27(17-18-28)26(29)22-11-6-3-7-12-22/h2-7,9-12,14-15,19,28H,8,13,16-18,20H2,1H3