propyl 4-(2-naphthalen-2-yloxyethanoylcarbamothioylamino)benzoate

Systemtic Name: propyl 4-(2-naphthalen-2-yloxyethanoylcarbamothioylamino)benzoate Openeye Name: propyl 4-[[2-(2-naphthyloxy)acetyl]carbamothioylamino]benzoate CAS Name: 4-[[[[2-(2-naphthalenyloxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(2-naphthalen-2-yloxyacetyl)carbamothioylamino]benzoate Traditional Name: 4-[[2-(2-naphthoxy)acetyl]thiocarbamoylamino]benzoic acid propyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H22N2O4S/c1-2-13-28-22(27)17-7-10-19(11-8-17)24-23(30)25-21(26)15-29-20-12-9-16-5-3-4-6-18(16)14-20/h3-12,14H,2,13,15H2,1H3,(H2,24,25,26,30)