2-[(4-ethylphenyl)-oxidanyl-[2-(thiomorpholin-4-ylmethyl)phenyl]methyl]-N-methyl-benzamide

Systemtic Name: 2-[(4-ethylphenyl)-oxidanyl-[2-(thiomorpholin-4-ylmethyl)phenyl]methyl]-N-methyl-benzamide Openeye Name: 2-[(4-ethylphenyl)-hydroxy-[2-(thiomorpholinomethyl)phenyl]methyl]-N-methyl-benzamide CAS Name: 2-[(4-ethylphenyl)-hydroxy-[2-(thiomorpholin-4-ylmethyl)phenyl]methyl]-N-methylbenzamide IUPAC Name: 2-[(4-ethylphenyl)-hydroxy-[2-(thiomorpholin-4-ylmethyl)phenyl]methyl]-N-methylbenzamide Traditional Name: 2-[(4-ethylphenyl)-hydroxy-[2-(thiomorpholinomethyl)phenyl]methyl]-N-methyl-benzamide Formula: C28H32N2O2S MolecularWeight: 460.63088

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CC=C2CN3CCSCC3)(C4=CC=CC=C4C(=O)NC)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CC=C2CN3CCSCC3)(C4=CC=CC=C4C(=O)NC)O

InChI

InChI=1S/C28H32N2O2S/c1-3-21-12-14-23(15-13-21)28(32,26-11-7-5-9-24(26)27(31)29-2)25-10-6-4-8-22(25)20-30-16-18-33-19-17-30/h4-15,32H,3,16-20H2,1-2H3,(H,29,31)