3-[octyl(phenyl)amino]propanethioamide

Systemtic Name: 3-[octyl(phenyl)amino]propanethioamide Openeye Name: 3-(N-octylanilino)propanethioamide CAS Name: 3-(N-octylanilino)propanethioamide IUPAC Name: 3-(N-octylanilino)propanethioamide Traditional Name: 3-(N-octylanilino)thiopropionamide Formula: C17H28N2S MolecularWeight: 292.48262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCC(=S)N)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCN(CCC(=S)N)C1=CC=CC=C1

InChI

InChI=1S/C17H28N2S/c1-2-3-4-5-6-10-14-19(15-13-17(18)20)16-11-8-7-9-12-16/h7-9,11-12H,2-6,10,13-15H2,1H3,(H2,18,20)