butyl 4-(1-phenylethylcarbamothioylamino)benzoate

Systemtic Name: butyl 4-(1-phenylethylcarbamothioylamino)benzoate Openeye Name: butyl 4-(1-phenylethylcarbamothioylamino)benzoate CAS Name: 4-[[(1-phenylethylamino)-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-(1-phenylethylcarbamothioylamino)benzoate Traditional Name: 4-(1-phenylethylthiocarbamoylamino)benzoic acid butyl ester Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(C)C2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(C)C2=CC=CC=C2

InChI

InChI=1S/C20H24N2O2S/c1-3-4-14-24-19(23)17-10-12-18(13-11-17)22-20(25)21-15(2)16-8-6-5-7-9-16/h5-13,15H,3-4,14H2,1-2H3,(H2,21,22,25)