3-methyl-N-phenethyl-pentanethioamide

Systemtic Name: 3-methyl-N-phenethyl-pentanethioamide Openeye Name: 3-methyl-N-phenethyl-pentanethioamide CAS Name: 3-methyl-N-phenethylpentanethioamide IUPAC Name: 3-methyl-N-phenethylpentanethioamide Traditional Name: 3-methyl-N-phenethyl-thiovaleramide Formula: C14H21NS MolecularWeight: 235.38824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=S)NCCC1=CC=CC=C1

Isomeric SMILES

CCC(C)CC(=S)NCCC1=CC=CC=C1

InChI

InChI=1S/C14H21NS/c1-3-12(2)11-14(16)15-10-9-13-7-5-4-6-8-13/h4-8,12H,3,9-11H2,1-2H3,(H,15,16)