N-(2-ethyl-6-methyl-phenyl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: 3-benzylsulfanyl-N-(2-ethyl-6-methyl-phenyl)propanamide CAS Name: N-(2-ethyl-6-methylphenyl)-3-(phenylmethylthio)propanamide IUPAC Name: 3-benzylsulfanyl-N-(2-ethyl-6-methylphenyl)propanamide Traditional Name: 3-(benzylthio)-N-(2-ethyl-6-methyl-phenyl)propionamide Formula: C19H23NOS MolecularWeight: 313.45702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CCSCC2=CC=CC=C2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CCSCC2=CC=CC=C2)C

InChI

InChI=1S/C19H23NOS/c1-3-17-11-7-8-15(2)19(17)20-18(21)12-13-22-14-16-9-5-4-6-10-16/h4-11H,3,12-14H2,1-2H3,(H,20,21)