ethyl 3-(naphthalen-1-ylmethylcarbamothioylamino)benzoate

Systemtic Name: ethyl 3-(naphthalen-1-ylmethylcarbamothioylamino)benzoate Openeye Name: ethyl 3-(1-naphthylmethylcarbamothioylamino)benzoate CAS Name: 3-[[(1-naphthalenylmethylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(naphthalen-1-ylmethylcarbamothioylamino)benzoate Traditional Name: 3-(1-naphthylmethylthiocarbamoylamino)benzoic acid ethyl ester Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=S)NCC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=S)NCC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H20N2O2S/c1-2-25-20(24)16-9-6-11-18(13-16)23-21(26)22-14-17-10-5-8-15-7-3-4-12-19(15)17/h3-13H,2,14H2,1H3,(H2,22,23,26)