N-[3-(2-phenylethanoylcarbamothioylamino)phenyl]pentanamide

Systemtic Name: N-[3-(2-phenylethanoylcarbamothioylamino)phenyl]pentanamide Openeye Name: N-[3-[(2-phenylacetyl)carbamothioylamino]phenyl]pentanamide CAS Name: N-[3-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]phenyl]pentanamide IUPAC Name: N-[3-[(2-phenylacetyl)carbamothioylamino]phenyl]pentanamide Traditional Name: N-[3-[(2-phenylacetyl)thiocarbamoylamino]phenyl]valeramide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H23N3O2S/c1-2-3-12-18(24)21-16-10-7-11-17(14-16)22-20(26)23-19(25)13-15-8-5-4-6-9-15/h4-11,14H,2-3,12-13H2,1H3,(H,21,24)(H2,22,23,25,26)