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

Systemtic Name: N-[3-(2-phenoxyethanoylcarbamothioylamino)phenyl]pentanamide Openeye Name: N-[3-[(2-phenoxyacetyl)carbamothioylamino]phenyl]pentanamide CAS Name: N-[3-[[[(1-oxo-2-phenoxyethyl)amino]-sulfanylidenemethyl]amino]phenyl]pentanamide IUPAC Name: N-[3-[(2-phenoxyacetyl)carbamothioylamino]phenyl]pentanamide Traditional Name: N-[3-[(2-phenoxyacetyl)thiocarbamoylamino]phenyl]valeramide Formula: C20H23N3O3S MolecularWeight: 385.47992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C20H23N3O3S/c1-2-3-12-18(24)21-15-8-7-9-16(13-15)22-20(27)23-19(25)14-26-17-10-5-4-6-11-17/h4-11,13H,2-3,12,14H2,1H3,(H,21,24)(H2,22,23,25,27)