propyl 4-(2-naphthalen-1-ylethanoylcarbamothioylamino)benzoate

Systemtic Name: propyl 4-(2-naphthalen-1-ylethanoylcarbamothioylamino)benzoate Openeye Name: propyl 4-[[2-(1-naphthyl)acetyl]carbamothioylamino]benzoate CAS Name: 4-[[[[2-(1-naphthalenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(2-naphthalen-1-ylacetyl)carbamothioylamino]benzoate Traditional Name: 4-[[2-(1-naphthyl)acetyl]thiocarbamoylamino]benzoic acid propyl ester Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H22N2O3S/c1-2-14-28-22(27)17-10-12-19(13-11-17)24-23(29)25-21(26)15-18-8-5-7-16-6-3-4-9-20(16)18/h3-13H,2,14-15H2,1H3,(H2,24,25,26,29)