3-[heptyl(phenyl)amino]propanethioamide

Systemtic Name: 3-[heptyl(phenyl)amino]propanethioamide Openeye Name: 3-(N-heptylanilino)propanethioamide CAS Name: 3-(N-heptylanilino)propanethioamide IUPAC Name: 3-(N-heptylanilino)propanethioamide Traditional Name: 3-(N-heptylanilino)thiopropionamide Formula: C16H26N2S MolecularWeight: 278.45604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2S/c1-2-3-4-5-9-13-18(14-12-16(17)19)15-10-7-6-8-11-15/h6-8,10-11H,2-5,9,12-14H2,1H3,(H2,17,19)