N-(heptylcarbamothioyl)-3-phenyl-propanamide

Systemtic Name: N-(heptylcarbamothioyl)-3-phenyl-propanamide Openeye Name: N-(heptylcarbamothioyl)-3-phenyl-propanamide CAS Name: N-[(heptylamino)-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-(heptylcarbamothioyl)-3-phenylpropanamide Traditional Name: N-(heptylthiocarbamoyl)-3-phenyl-propionamide Formula: C17H26N2OS MolecularWeight: 306.46614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCNC(=S)NC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C17H26N2OS/c1-2-3-4-5-9-14-18-17(21)19-16(20)13-12-15-10-7-6-8-11-15/h6-8,10-11H,2-5,9,12-14H2,1H3,(H2,18,19,20,21)